Vitas-M small molecule compound
11-(4-chlorophenyl)-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK040150
SMILES CCC(=O)N1C(c2ccc(cc2)Cl)C2=C(Nc3c1cccc3)CCCC2=O
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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 C22H21ClN2O2 MW 380.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN2O2/c1-2-20(27)25-18-8-4-3-6-16(18)24-17-7-5-9-19(26)21(17)22(25)14-10-12-15(23)13-11-14/h3-4,6,8,10-13,22,24H,2,5,7,9H2,1H3InChIKey
OIRWWQGCTMWMLA-UHFFFAOYSA-NSynonyms
11(4chlorophenyl)10propanoyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(4chlorophenyl)5propanoyl891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CCC(=O)N1C(C2=C(CCCC2=O)NC3=CC=CC=C31)C4=CC=C(C=C4)Cl
CCC(=O)N1C(c2ccc(cc2)Cl)C2=C(Nc3c1cccc3)CCCC2=O
InChI=1SC22H21ClN2O2c1220(27)2518843616(18)241775919(26)21(17)22(25)14101215(23)131114h346810132224H2579H21H3
MFCD08050648
STK040150
ZINC000004608392
ZINC000004608393
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