Vitas-M small molecule compound
10-[(3,4-dichlorophenyl)carbonyl]-3-(4-methoxyphenyl)-11-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK262366
SMILES COc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1cccs1)C(=O)c1ccc(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 C31H24Cl2N2O3S MW 575.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H24Cl2N2O3S/c1-38-21-11-8-18(9-12-21)20-16-25-29(27(36)17-20)30(28-7-4-14-39-28)35(26-6-3-2-5-24(26)34-25)31(37)19-10-13-22(32)23(33)15-19/h2-15,20,30,34H,16-17H2,1H3InChIKey
XOIXFHGRDIXCQX-UHFFFAOYSA-NSynonyms
10((34DICHLOROPHENYL)CARBONYL)3(4METHOXYPHENYL)11(2THIENYL)234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
10((34dichlorophenyl)carbonyl)3(4methoxyphenyl)11(thiophen2yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
5(34dichlorobenzoyl)9(4methoxyphenyl)6thiophen2yl891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
COC1=CC=C(C=C1)C2CC3=C(C(N(C4=CC=CC=C4N3)C(=O)C5=CC(=C(C=C5)Cl)Cl)C6=CC=CS6)C(=O)C2
InChI=1SC31H24Cl2N2O3Sc1382111818(91221)20162529(27(36)1720)30(2874143928)35(26632524(26)3425)31(37)19101322(32)23(33)1519h215203034H1617H21H3
MFCD08547673
ZINC000098042802
ZINC000098042805
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