Vitas-M small molecule compound
N-(3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2-methoxyphenyl)quinoline-4-carboxamide
Catalog ID
STK425417
SMILES COc1ccccc1c1nc2ccccc2c(c1)C(=O)Nc1sc2c(c1C(=O)N)CCC(C2)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 C27H25N3O3S MW 471.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O3S/c1-15-11-12-18-23(13-15)34-27(24(18)25(28)31)30-26(32)19-14-21(17-8-4-6-10-22(17)33-2)29-20-9-5-3-7-16(19)20/h3-10,14-15H,11-13H2,1-2H3,(H2,28,31)(H,30,32)InChIKey
JZTQNQCQEFDZLE-UHFFFAOYSA-NSynonyms
CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5OC
InChI=1SC27H25N3O3Sc11511121823(1315)3427(24(18)25(28)31)3026(32)191421(178461022(17)332)2920953716(19)20h3101415H1113H212H3(H22831)(H3032)
MFCD02375062
N(3carbamoyl6methyl4567tetrahydro1benzothiophen2yl)2(2methoxyphenyl)quinoline4carboxamide
ZINC000000649361
ZINC000000649364
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