Vitas-M small molecule compound

11-(3-chlorophenyl)-3,3-dimethyl-1-oxo-N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide

Catalog ID
STK057277
SMILES Clc1cccc(c1)C1C2=C(Nc3c(N1C(=O)NC14CC5CC(C4)CC(C1)C5)cccc3)CC(CC2=O)(C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C32H36ClN3O2 MW 530.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H36ClN3O2/c1-31(2)17-25-28(27(37)18-31)29(22-6-5-7-23(33)13-22)36(26-9-4-3-8-24(26)34-25)30(38)35-32-14-19-10-20(15-32)12-21(11-19)16-32/h3-9,13,19-21,29,34H,10-12,14-18H2,1-2H3,(H,35,38)
InChIKey
IYHIWNUXEBERCY-UHFFFAOYSA-N
Synonyms

11(3chlorophenyl)33dimethyl1oxoN(tricyclo(3311~37~)dec1yl)1234511hexahydro10Hdibenzo(be)(14)diazepine10carboxamide
CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)NC45CC6CC(C4)CC(C6)C5)C7=CC(=CC=C7)Cl)C(=O)C1)C
Clc1cccc(c1)C1C2=C(Nc3c(N1C(=O)NC14CC5CC(C4)CC(C1)C5)cccc3)CC(CC2=O)(C)C
InChI=1SC32H36ClN3O2c131(2)172528(27(37)1831)29(2265723(33)1322)36(26943824(26)3425)30(38)353214191020(1532)1221(1119)1632h391319212934H10121418H212H3(H3538)
MFCD03488804
N(1adamantyl)6(3chlorophenyl)99dimethyl7oxo681011tetrahydrobenzo(b)(14)benzodiazepine5carboxamide
STK057277
ZINC000008892166
ZINC000008892448

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Available files

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