Vitas-M small molecule compound
3-{[3-(methoxycarbonyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]carbamoyl}bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STL503888
SMILES COC(=O)c1c(NC(=O)C2C3C=CC(C2C(=O)O)C3)sc2c1CCC2
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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 C18H19NO5S MW 361.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO5S/c1-24-18(23)14-10-3-2-4-11(10)25-16(14)19-15(20)12-8-5-6-9(7-8)13(12)17(21)22/h5-6,8-9,12-13H,2-4,7H2,1H3,(H,19,20)(H,21,22)InChIKey
OREQBSAEMUMLFL-UHFFFAOYSA-NSynonyms
2((3METHOXYCARBONYL56DIHYDRO4HCYCLOPENTA(B)THIOPHEN2YL)CARBAMOYL)BICYCLO(221)HEPT5ENE3CARBOXYLICACID
2886658
3((3(METHOXYCARBONYL)4H5H6HCYCLOPENTA(B)THIOPHEN2YL)CARBAMOYL)BICYCLO(221)HEPT5ENE2CARBOXYLICACID
3((3(methoxycarbonyl)56dihydro4Hcyclopenta(b)thiophen2yl)carbamoyl)bicyclo(221)hept5ene2carboxylicacid
3((3methoxycarbonyl56dihydro4~(H)cyclopenta(b)thiophen2yl)carbamoyl)bicyclo(221)hept5ene2carboxylicacid
3(N(3(METHOXYCARBONYL)456TRIHYDROCYCLOPENTA(12D)THIOPHEN2YL)CARBAMOYL)BICYCLO(221)HEPT5ENE2CARBOXYLICACID
InChI=1SC18H19NO5Sc12418(23)141032411(10)2516(14)1915(20)128569(78)13(12)17(21)22h56891213H247H21H3(H1920)(H2122)
MFCD01355659
ZINC000100676721
ZINC000239378399
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