Vitas-M small molecule compound
4-(3-chloro-4-hydroxy-5-methoxyphenyl)-7-(3,4-dimethoxyphenyl)-2-methyl-N-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Catalog ID
STK404816
SMILES COc1cc(cc(c1O)Cl)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccc(c(c1)OC)OC)C(=O)Nc1ccc(cc1)C
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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 C33H33ClN2O6 MW 589.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33ClN2O6/c1-17-6-9-22(10-7-17)36-33(39)29-18(2)35-24-13-20(19-8-11-26(40-3)27(15-19)41-4)14-25(37)31(24)30(29)21-12-23(34)32(38)28(16-21)42-5/h6-12,15-16,20,30,35,38H,13-14H2,1-5H3,(H,36,39)InChIKey
JYBMJDQRLZYXQR-UHFFFAOYSA-NSynonyms
4(3chloro4hydroxy5methoxyphenyl)7(34dimethoxyphenyl)2methylN(4methylphenyl)5oxo145678hexahydroquinoline3carboxamide
4(3chloro4hydroxy5methoxyphenyl)7(34dimethoxyphenyl)2methylN(4methylphenyl)5oxo4678tetrahydro1Hquinoline3carboxamide
CC1=CC=C(C=C1)NC(=O)C2=C(NC3=C(C2C4=CC(=C(C(=C4)Cl)O)OC)C(=O)CC(C3)C5=CC(=C(C=C5)OC)OC)C
InChI=1SC33H33ClN2O6c1176922(10717)3633(39)2918(2)35241320(1981126(403)27(1519)414)1425(37)31(24)30(29)211223(34)32(38)28(1621)425h612151620303538H1314H215H3(H3639)
MFCD06193988
ZINC000097939873
ZINC000097939876
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