Vitas-M small molecule compound
methyl 4-[7-chloro-3-(4-chlorophenyl)-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]benzoate
Catalog ID
STK038487
SMILES COC(=O)c1ccc(cc1)C1Nc2ccc(cc2NC2=C1C(=O)CC(C2)c1ccc(cc1)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 C27H22Cl2N2O3 MW 493.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22Cl2N2O3/c1-34-27(33)17-4-2-16(3-5-17)26-25-23(30-22-14-20(29)10-11-21(22)31-26)12-18(13-24(25)32)15-6-8-19(28)9-7-15/h2-11,14,18,26,30-31H,12-13H2,1H3InChIKey
YJHPXUYTSYFHDK-UHFFFAOYSA-NSynonyms
364628-03-5364628035
COC(=O)C1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)Cl)NC5=C(N2)C=CC(=C5)Cl
COC(=O)c1ccc(cc1)C1Nc2ccc(cc2NC2=C1C(=O)CC(C2)c1ccc(cc1)Cl)Cl
InChI=1SC27H22Cl2N2O3c13427(33)174216(3517)262523(30221420(29)101121(22)3126)1218(1324(25)32)156819(28)9715h2111418263031H1213H21H3
methyl4(2chloro9(4chlorophenyl)7oxo56891011hexahydrobenzo(b)(14)benzodiazepin6yl)benzoate
methyl4(7chloro3(4chlorophenyl)1oxo23451011hexahydro1Hdibenzo(be)(14)diazepin11yl)benzoate
MFCD03161560
STK038487
ZINC000009299693
ZINC000009600975
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