Vitas-M small molecule compound
2-phenylethyl 7-(4-chlorophenyl)-4-(2,4-dichlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK012153
SMILES Clc1ccc(c(c1)Cl)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccc(cc1)Cl)C(=O)OCCc1ccccc1
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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 C31H26Cl3NO3 MW 566.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26Cl3NO3/c1-18-28(31(37)38-14-13-19-5-3-2-4-6-19)29(24-12-11-23(33)17-25(24)34)30-26(35-18)15-21(16-27(30)36)20-7-9-22(32)10-8-20/h2-12,17,21,29,35H,13-16H2,1H3InChIKey
DQTOFVYADMSLQO-UHFFFAOYSA-NSynonyms
2phenylethyl7(4chlorophenyl)4(24dichlorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2phenylethyl7(4chlorophenyl)4(24dichlorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)Cl)C4=C(C=C(C=C4)Cl)Cl)C(=O)OCCC5=CC=CC=C5
Clc1ccc(c(c1)Cl)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccc(cc1)Cl)C(=O)OCCc1ccccc1
InChI=1SC31H26Cl3NO3c11828(31(37)381413195324619)29(24121123(33)1725(24)34)3026(3518)1521(1627(30)36)207922(32)10820h21217212935H1316H21H3
MFCD01823921
STK012153
ZINC000002757626
ZINC000002757629
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