Vitas-M small molecule compound
2-phenylethyl 2-methyl-4-(6-methyl-4-oxo-4H-chromen-3-yl)-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK402938
SMILES Cc1ccc2c(c1)c(=O)c(co2)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 C33H29NO5S MW 551.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H29NO5S/c1-19-10-11-27-23(15-19)32(36)24(18-39-27)30-29(33(37)38-13-12-21-7-4-3-5-8-21)20(2)34-25-16-22(17-26(35)31(25)30)28-9-6-14-40-28/h3-11,14-15,18,22,30,34H,12-13,16-17H2,1-2H3InChIKey
BTNGZFOOMNHOFP-UHFFFAOYSA-NSynonyms
2phenylethyl2methyl4(6methyl4oxo4Hchromen3yl)5oxo7(thiophen2yl)145678hexahydroquinoline3carboxylate
2phenylethyl2methyl4(6methyl4oxochromen3yl)5oxo7thiophen2yl4678tetrahydro1Hquinoline3carboxylate
CC1=CC2=C(C=C1)OC=C(C2=O)C3C4=C(CC(CC4=O)C5=CC=CS5)NC(=C3C(=O)OCCC6=CC=CC=C6)C
InChI=1SC33H29NO5Sc11910112723(1519)32(36)24(183927)3029(33(37)381312217435821)20(2)34251622(1726(35)31(25)30)2896144028h311141518223034H12131617H212H3
MFCD03370967
ZINC000001074608
ZINC000001074618
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