KEGG   DRUG: ClothiapineHelp
Entry
D01597                      Drug                                   

Name
Clothiapine (USAN);
Clotiapine (JAN/INN);
Entumin (TN)
Formula
C18H18ClN3S
Exact mass
343.091
Mol weight
343.8736
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Remark
ATC code: N05AH06
Efficacy
Antipsychotic
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N05 PSYCHOLEPTICS
   N05A ANTIPSYCHOTICS
    N05AH Diazepines, oxazepines and thiazepines
     N05AH06 Clotiapine
      D01597  Clothiapine (USAN)
BRITE hierarchy
Other DBs
CAS: 2058-52-8
PubChem: 7848660
ChEBI: 31424
ChEMBL: CHEMBL304902
LigandBox: D01597
NIKKAJI: J3.697H
LinkDB All DBs
KCF data Show

ATOM        23
            1   C2y C    15.8834  -14.2894
            2   C8y C    15.0413  -13.1798
            3   C8y C    15.3765  -11.8230
            4   S2x S    16.6375  -11.2449
            5   N2x N    17.2892  -14.3146
            6   C8y C    17.8911  -11.8672
            7   C8y C    18.1776  -13.2359
            8   C8x C    14.3694  -10.8546
            9   C8x C    13.0274  -11.2427
            10  C8y C    12.6922  -12.5995
            11  C8x C    13.6993  -13.5676
            12  C8x C    19.5088  -13.6730
            13  C8x C    20.5530  -12.7386
            14  C8x C    20.2666  -11.3699
            15  C8x C    18.9352  -10.9328
            16  X   Cl   11.3274  -12.9939
            17  N1y N    15.2489  -15.5391
            18  C1x C    13.8473  -15.5391
            19  C1x C    13.1465  -16.7529
            20  N1y N    13.8473  -17.9669
            21  C1x C    15.2489  -17.9669
            22  C1x C    15.9497  -16.7529
            23  C1a C    13.1403  -19.1909
BOND        26
            1     3   4 1
            2     1   5 2
            3     4   6 1
            4     2   3 1
            5     5   7 1
            6     1   2 1
            7     6   7 1
            8     3   8 2
            9     8   9 1
            10    9  10 2
            11   10  11 1
            12    2  11 2
            13    7  12 2
            14   12  13 1
            15   13  14 2
            16   14  15 1
            17    6  15 2
            18   10  16 1
            19    1  17 1
            20   17  18 1
            21   18  19 1
            22   19  20 1
            23   20  21 1
            24   21  22 1
            25   17  22 1
            26   20  23 1

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