ethyl 4-(2-methylpropyl)-2-[(4-methylsulfonylphenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(2-methylpropyl)-2-[(4-methylsulfonylphenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-isobutyl-2-[(4-methylsulfonylbenzoyl)amino]thiophene-3-carboxylate CAS Name: 4-(2-methylpropyl)-2-[[(4-methylsulfonylphenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-methylpropyl)-2-[(4-methylsulfonylbenzoyl)amino]thiophene-3-carboxylate Traditional Name: 4-isobutyl-2-[(4-mesylbenzoyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C19H23NO5S2 MolecularWeight: 409.51962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1CC(C)C)NC(=O)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1CC(C)C)NC(=O)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C19H23NO5S2/c1-5-25-19(22)16-14(10-12(2)3)11-26-18(16)20-17(21)13-6-8-15(9-7-13)27(4,23)24/h6-9,11-12H,5,10H2,1-4H3,(H,20,21)