Vitas-M small molecule compound
2-phenylethyl 2-methyl-5-oxo-7-(thiophen-2-yl)-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK403193
SMILES COc1c(OC)cc(cc1OC)C1C(=C(C)NC2=C1C(=O)CC(C2)c1cccs1)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 C32H33NO6S MW 559.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33NO6S/c1-19-28(32(35)39-13-12-20-9-6-5-7-10-20)29(22-17-25(36-2)31(38-4)26(18-22)37-3)30-23(33-19)15-21(16-24(30)34)27-11-8-14-40-27/h5-11,14,17-18,21,29,33H,12-13,15-16H2,1-4H3InChIKey
HNVAEUKDYVXWSU-UHFFFAOYSA-NSynonyms
2phenylethyl2methyl5oxo7(thiophen2yl)4(345trimethoxyphenyl)145678hexahydroquinoline3carboxylate
2phenylethyl2methyl5oxo7thiophen2yl4(345trimethoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CS3)C4=CC(=C(C(=C4)OC)OC)OC)C(=O)OCCC5=CC=CC=C5
InChI=1SC32H33NO6Sc11928(32(35)3913122096571020)29(221725(362)31(384)26(1822)373)3023(3319)1521(1624(30)34)27118144027h511141718212933H12131516H214H3
MFCD03312422
ZINC000001439740
ZINC000001439743
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