Vitas-M small molecule compound
11-(4-methoxyphenyl)-3-methyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK789463
SMILES COc1ccc(cc1)C1Nc2ccccc2NC2=C1C(=O)CC(C2)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 C21H22N2O2 MW 334.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O2/c1-13-11-18-20(19(24)12-13)21(14-7-9-15(25-2)10-8-14)23-17-6-4-3-5-16(17)22-18/h3-10,13,21-23H,11-12H2,1-2H3InChIKey
VACBGWNEWYEGKL-UHFFFAOYSA-NSynonyms
726200-22-211(4methoxyphenyl)3methyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(4methoxyphenyl)9methyl56891011hexahydrobenzo(b)(14)benzodiazepin7one
726200222
CC1CC2=C(C(NC3=CC=CC=C3N2)C4=CC=C(C=C4)OC)C(=O)C1
InChI=1SC21H22N2O2c113111820(19(24)1213)21(147915(252)10814)2317643516(17)2218h310132123H1112H212H3
MFCD06014885
ZINC000009089985
ZINC000009089988
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