Vitas-M small molecule compound
3-({4-(4-fluorophenyl)-3-[(propan-2-yloxy)carbonyl]thiophen-2-yl}carbamoyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STK471726
SMILES CC(OC(=O)c1c(scc1c1ccc(cc1)F)NC(=O)C1C2C=CC(C1C(=O)O)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 C23H22FNO5S MW 443.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22FNO5S/c1-11(2)30-23(29)19-16(12-5-7-15(24)8-6-12)10-31-21(19)25-20(26)17-13-3-4-14(9-13)18(17)22(27)28/h3-8,10-11,13-14,17-18H,9H2,1-2H3,(H,25,26)(H,27,28)InChIKey
GWUDJFDDNGZWMP-UHFFFAOYSA-NSynonyms
2((4(4fluorophenyl)3propan2yloxycarbonylthiophen2yl)carbamoyl)bicyclo(221)hept5ene3carboxylicacid
3((4(4fluorophenyl)3((propan2yloxy)carbonyl)thiophen2yl)carbamoyl)bicyclo(221)hept5ene2carboxylicacid
3(N(4(4FLUOROPHENYL)3((METHYLETHYL)OXYCARBONYL)2THIENYL)CARBAMOYL)BICYCLO(221)HEPT5ENE2CARBOXYLICACID
CC(C)OC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)C3C4CC(C3C(=O)O)C=C4
InChI=1SC23H22FNO5Sc111(2)3023(29)1916(125715(24)8612)103121(19)2520(26)17133414(913)18(17)22(27)28h38101113141718H9H212H3(H2526)(H2728)
MFCD06027675
ZINC000102343722
ZINC000239073293
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