Vitas-M small molecule compound
2-{[(3-methylphenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
Catalog ID
STK536264
SMILES Cc1cccc(c1)C(=O)Nc1sc2c(c1C(=O)O)CCCC2
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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 C17H17NO3S MW 315.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO3S/c1-10-5-4-6-11(9-10)15(19)18-16-14(17(20)21)12-7-2-3-8-13(12)22-16/h4-6,9H,2-3,7-8H2,1H3,(H,18,19)(H,20,21)InChIKey
QMARCNKWRJFPOJ-UHFFFAOYSA-NSynonyms
2(((3methylphenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylicacid
2((3methylbenzoyl)amino)4567tetrahydro1benzothiophene3carboxylicacid
2(3methylbenzamido)4567tetrahydrobenzo(b)thiophene3carboxylicacid
CC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)O
InChI=1SC17H17NO3Sc11054611(910)15(19)181614(17(20)21)12723813(12)2216h469H2378H21H3(H1819)(H2021)
MFCD01412806
ZINC000000191615
ZINC191615
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