Vitas-M small molecule compound
4-methoxybenzyl 2-methyl-7-(4-methylphenyl)-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK407100
SMILES COc1ccc(cc1)COC(=O)C1=C(C)NC2=C(C1c1cccs1)C(=O)CC(C2)c1ccc(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 C30H29NO4S MW 499.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29NO4S/c1-18-6-10-21(11-7-18)22-15-24-28(25(32)16-22)29(26-5-4-14-36-26)27(19(2)31-24)30(33)35-17-20-8-12-23(34-3)13-9-20/h4-14,22,29,31H,15-17H2,1-3H3InChIKey
HLLCHJSCALCDHH-UHFFFAOYSA-NSynonyms
(4methoxyphenyl)methyl2methyl7(4methylphenyl)5oxo4thiophen2yl4678tetrahydro1Hquinoline3carboxylate
4methoxybenzyl2methyl7(4methylphenyl)5oxo4(thiophen2yl)145678hexahydroquinoline3carboxylate
CC1=CC=C(C=C1)C2CC3=C(C(C(=C(N3)C)C(=O)OCC4=CC=C(C=C4)OC)C5=CC=CS5)C(=O)C2
InChI=1SC30H29NO4Sc11861021(11718)22152428(25(32)1622)29(2654143626)27(19(2)3124)30(33)35172081223(343)13920h414222931H1517H213H3
MFCD06627476
ZINC000016426330
ZINC000016426340
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