Vitas-M small molecule compound
benzyl 2-methyl-4-(5-methylthiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK090565
SMILES Cc1ccc(s1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCc1ccccc1
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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 C23H23NO3S MW 393.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23NO3S/c1-14-11-12-19(28-14)22-20(23(26)27-13-16-7-4-3-5-8-16)15(2)24-17-9-6-10-18(25)21(17)22/h3-5,7-8,11-12,22,24H,6,9-10,13H2,1-2H3InChIKey
KNKQOWFWCLCCPC-UHFFFAOYSA-NSynonyms
benzyl2methyl4(5methylthiophen2yl)5oxo145678hexahydroquinoline3carboxylate
benzyl2methyl4(5methylthiophen2yl)5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=CC=C(S1)C2C3=C(CCCC3=O)NC(=C2C(=O)OCC4=CC=CC=C4)C
Cc1ccc(s1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCc1ccccc1
InChI=1SC23H23NO3Sc114111219(2814)2220(23(26)2713167435816)15(2)2417961018(25)21(17)22h357811122224H691013H212H3
MFCD02104481
STK090565
ZINC000001220055
ZINC000001220056
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