Vitas-M small molecule compound
11-{4-[(4-chlorobenzyl)oxy]-3-ethoxyphenyl}-3-(4-chlorophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK548359
SMILES CCOc1cc(ccc1OCc1ccc(cc1)Cl)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 C34H30Cl2N2O3 MW 585.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H30Cl2N2O3/c1-2-40-32-19-23(11-16-31(32)41-20-21-7-12-25(35)13-8-21)34-33-29(37-27-5-3-4-6-28(27)38-34)17-24(18-30(33)39)22-9-14-26(36)15-10-22/h3-16,19,24,34,37-38H,2,17-18,20H2,1H3InChIKey
WKHDPUCKQSJOJS-UHFFFAOYSA-NSynonyms
11(4((4chlorobenzyl)oxy)3ethoxyphenyl)3(4chlorophenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(4chlorophenyl)6(4((4chlorophenyl)methoxy)3ethoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)Cl)NC5=CC=CC=C5N2)OCC6=CC=C(C=C6)Cl
InChI=1SC34H30Cl2N2O3c1240321923(111631(32)41202171225(35)13821)343329(3727534628(27)3834)1724(1830(33)39)2291426(36)151022h3161924343738H2171820H21H3
MFCD03296275
ZINC000053339596
ZINC000053339606
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