Vitas-M small molecule compound

2-{[(2-methylphenyl)carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid

Catalog ID
STK046961
SMILES O=C(c1ccccc1C)Nc1sc2c(c1C(=O)O)CCC2

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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 C16H15NO3S MW 301.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15NO3S/c1-9-5-2-3-6-10(9)14(18)17-15-13(16(19)20)11-7-4-8-12(11)21-15/h2-3,5-6H,4,7-8H2,1H3,(H,17,18)(H,19,20)
InChIKey
IXHSGZNTCIERPZ-UHFFFAOYSA-N
Synonyms
380645-31-8
2(((2METHYLPHENYL)CARBONYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLICACID
2(((2METHYLPHENYL)OXOMETHYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLICACID
2((2METHYLBENZOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLICACID
2((2METHYLPHENYL)CARBONYLAMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLICACID
2(2methylbenzamido)56dihydro4Hcyclopenta(b)thiophene3carboxylicacid
2(OTOLUOYLAMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLICACID
380645318
CC1=CC=CC=C1C(=O)NC2=C(C3=C(S2)CCC3)C(=O)O
InChI=1SC16H15NO3Sc19523610(9)14(18)171513(16(19)20)1174812(11)2115h2356H478H21H3(H1718)(H1920)
MFCD02222291
O=C(c1ccccc1C)Nc1sc2c(c1C(=O)O)CCC2
STK046961
ZINC000000172994
ZINC172994

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.