Vitas-M small molecule compound
11-(3,4-dichlorophenyl)-3-(3,4-dimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK060231
SMILES COc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1ccc(c(c1)Cl)Cl
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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 C27H24Cl2N2O3 MW 495.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24Cl2N2O3/c1-33-24-10-8-15(14-25(24)34-2)17-12-22-26(23(32)13-17)27(16-7-9-18(28)19(29)11-16)31-21-6-4-3-5-20(21)30-22/h3-11,14,17,27,30-31H,12-13H2,1-2H3InChIKey
HYNFUZRDUBKOIQ-UHFFFAOYSA-NSynonyms
11(34dichlorophenyl)3(34dimethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(34dichlorophenyl)9(34dimethoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=C(C=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC(=C(C=C5)Cl)Cl)C(=O)C2)OC
COc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1ccc(c(c1)Cl)Cl
InChI=1SC27H24Cl2N2O3c1332410815(1425(24)342)17122226(23(32)1317)27(167918(28)19(29)1116)3121643520(21)3022h3111417273031H1213H212H3
MFCD02105013
STK060231
ZINC000004083650
ZINC000004083655
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