Vitas-M small molecule compound
ethyl 5-[(2-fluorophenyl)carbamoyl]-4-methyl-2-[(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)amino]thiophene-3-carboxylate
Catalog ID
STK034931
SMILES CCOC(=O)c1c(sc(c1C)C(=O)Nc1ccccc1F)NC(=O)C12CC3CC(C2)CC(C1)C3
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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 C26H29FN2O4S MW 484.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29FN2O4S/c1-3-33-24(31)20-14(2)21(22(30)28-19-7-5-4-6-18(19)27)34-23(20)29-25(32)26-11-15-8-16(12-26)10-17(9-15)13-26/h4-7,15-17H,3,8-13H2,1-2H3,(H,28,30)(H,29,32)InChIKey
LUKRJUYGWZIVFQ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2F)NC(=O)C34CC5CC(C3)CC(C5)C4
CCOC(=O)c1c(sc(c1C)C(=O)Nc1ccccc1F)NC(=O)C12CC3CC(C2)CC(C1)C3
ETHYL2(ADAMANTANE1CARBONYLAMINO)5((2FLUOROPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2(ADAMANTANYLCARBONYLAMINO)5(N(2FLUOROPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ethyl5((2fluorophenyl)carbamoyl)4methyl2((tricyclo(3311~37~)dec1ylcarbonyl)amino)thiophene3carboxylate
InChI=1SC26H29FN2O4Sc133324(31)2014(2)21(22(30)2819754618(19)27)3423(20)2925(32)261115816(1226)1017(915)1326h471517H3813H212H3(H2830)(H2932)
MFCD01824277
STK034931
ZINC000013941921
ZINC13941921
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