(4-pyrrolidin-1-ylcarbonylphenyl)methyl 2-(cyclopropylcarbonylamino)-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: (4-pyrrolidin-1-ylcarbonylphenyl)methyl 2-(cyclopropylcarbonylamino)-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: [4-(pyrrolidine-1-carbonyl)phenyl]methyl 2-(cyclopropanecarbonylamino)-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[cyclopropyl(oxo)methyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid [4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl ester IUPAC Name: [4-(pyrrolidine-1-carbonyl)phenyl]methyl 2-(cyclopropanecarbonylamino)-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-(cyclopropanecarbonylamino)-4,5-dimethyl-thiophene-3-carboxylic acid [4-(pyrrolidine-1-carbonyl)benzyl] ester Formula: C23H26N2O4S MolecularWeight: 426.52854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OCC2=CC=C(C=C2)C(=O)N3CCCC3)NC(=O)C4CC4)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OCC2=CC=C(C=C2)C(=O)N3CCCC3)NC(=O)C4CC4)C

InChI

InChI=1S/C23H26N2O4S/c1-14-15(2)30-21(24-20(26)17-9-10-17)19(14)23(28)29-13-16-5-7-18(8-6-16)22(27)25-11-3-4-12-25/h5-8,17H,3-4,9-13H2,1-2H3,(H,24,26)