[4-(4-fluorophenyl)-4-oxidanylidene-butyl] 2-(cyclopropylcarbonylamino)-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: [4-(4-fluorophenyl)-4-oxidanylidene-butyl] 2-(cyclopropylcarbonylamino)-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: [4-(4-fluorophenyl)-4-oxo-butyl] 2-(cyclopropanecarbonylamino)-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[cyclopropyl(oxo)methyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid [4-(4-fluorophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-fluorophenyl)-4-oxobutyl] 2-(cyclopropanecarbonylamino)-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-(cyclopropanecarbonylamino)-4,5-dimethyl-thiophene-3-carboxylic acid [4-(4-fluorophenyl)-4-keto-butyl] ester Formula: C21H22FNO4S MolecularWeight: 403.467083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OCCCC(=O)C2=CC=C(C=C2)F)NC(=O)C3CC3)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OCCCC(=O)C2=CC=C(C=C2)F)NC(=O)C3CC3)C

InChI

InChI=1S/C21H22FNO4S/c1-12-13(2)28-20(23-19(25)15-5-6-15)18(12)21(26)27-11-3-4-17(24)14-7-9-16(22)10-8-14/h7-10,15H,3-6,11H2,1-2H3,(H,23,25)