Vitas-M small molecule compound
11-(3-methoxyphenyl)-3-(4-methylphenyl)-10-[(3,4,5-trimethoxyphenyl)carbonyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK677936
SMILES COc1cccc(c1)C1C2=C(CC(CC2=O)c2ccc(cc2)C)Nc2c(N1C(=O)c1cc(OC)c(c(c1)OC)OC)cccc2
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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 C37H36N2O6 MW 604.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H36N2O6/c1-22-13-15-23(16-14-22)25-18-29-34(31(40)19-25)35(24-9-8-10-27(17-24)42-2)39(30-12-7-6-11-28(30)38-29)37(41)26-20-32(43-3)36(45-5)33(21-26)44-4/h6-17,20-21,25,35,38H,18-19H2,1-5H3InChIKey
HFWGGMFQMKEJNU-UHFFFAOYSA-NSynonyms
11(3methoxyphenyl)3(4methylphenyl)10((345trimethoxyphenyl)carbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(3methoxyphenyl)9(4methylphenyl)5(345trimethoxybenzoyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CC1=CC=C(C=C1)C2CC3=C(C(N(C4=CC=CC=C4N3)C(=O)C5=CC(=C(C(=C5)OC)OC)OC)C6=CC(=CC=C6)OC)C(=O)C2
InChI=1SC37H36N2O6c122131523(161422)25182934(31(40)1925)35(24981027(1724)422)39(3012761128(30)3829)37(41)262032(433)36(455)33(2126)444h6172021253538H1819H215H3
MFCD03036106
ZINC000098003638
ZINC000098003641
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