Vitas-M small molecule compound
3-{[3-(cyclopropylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]carbamoyl}bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STK470896
SMILES O=C(C1C2C=CC(C1C(=O)O)C2)Nc1sc2c(c1C(=O)NC1CC1)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 C20H22N2O4S MW 386.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O4S/c23-17(14-9-4-5-10(8-9)15(14)20(25)26)22-19-16(18(24)21-11-6-7-11)12-2-1-3-13(12)27-19/h4-5,9-11,14-15H,1-3,6-8H2,(H,21,24)(H,22,23)(H,25,26)InChIKey
FICJFSKNWWWKGM-UHFFFAOYSA-NSynonyms
2((3(cyclopropylcarbamoyl)56dihydro4Hcyclopenta(b)thiophen2yl)carbamoyl)bicyclo(221)hept5ene3carboxylicacid
3((3(cyclopropylcarbamoyl)56dihydro4Hcyclopenta(b)thiophen2yl)carbamoyl)bicyclo(221)hept5ene2carboxylicacid
3(N(3(NCYCLOPROPYLCARBAMOYL)456TRIHYDROCYCLOPENTA(21D)THIOPHEN2YL)CARBAMOYL)BICYCLO(221)HEPT5ENE2CARBOXYLICACID
C1CC2=C(C1)SC(=C2C(=O)NC3CC3)NC(=O)C4C5CC(C4C(=O)O)C=C5
InChI=1SC20H22N2O4Sc2317(1494510(89)15(14)20(25)26)221916(18(24)21116711)1221313(12)2719h459111415H1368H2(H2124)(H2223)(H2526)
MFCD06021788
ZINC000102339954
ZINC000245227381
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