Vitas-M small molecule compound
3-(4-chlorophenyl)-11-(4-ethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK378330
SMILES CCOc1ccc(cc1)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccc(cc1)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 C27H25ClN2O2 MW 444.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25ClN2O2/c1-2-32-21-13-9-18(10-14-21)27-26-24(29-22-5-3-4-6-23(22)30-27)15-19(16-25(26)31)17-7-11-20(28)12-8-17/h3-14,19,27,29-30H,2,15-16H2,1H3InChIKey
RPJYQERFYOCLIV-UHFFFAOYSA-NSynonyms
3(4chlorophenyl)11(4ethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(4chlorophenyl)6(4ethoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
CCOC1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)Cl)NC5=CC=CC=C5N2
InChI=1SC27H25ClN2O2c12322113918(101421)272624(2922534623(22)3027)1519(1625(26)31)1771120(28)12817h31419272930H21516H21H3
MFCD01823915
ZINC000004062229
ZINC000004062256
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