[2-(1-cyclopropylethylamino)-2-oxidanylidene-ethyl] 2-(2,5-dimethylpyrrol-1-yl)thiophene-3-carboxylate

Systemtic Name: [2-(1-cyclopropylethylamino)-2-oxidanylidene-ethyl] 2-(2,5-dimethylpyrrol-1-yl)thiophene-3-carboxylate Openeye Name: [2-(1-cyclopropylethylamino)-2-oxo-ethyl] 2-(2,5-dimethylpyrrol-1-yl)thiophene-3-carboxylate CAS Name: 2-(2,5-dimethyl-1-pyrrolyl)-3-thiophenecarboxylic acid [2-(1-cyclopropylethylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-cyclopropylethylamino)-2-oxoethyl] 2-(2,5-dimethylpyrrol-1-yl)thiophene-3-carboxylate Traditional Name: 2-(2,5-dimethylpyrrol-1-yl)thiophene-3-carboxylic acid [2-(1-cyclopropylethylamino)-2-keto-ethyl] ester Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=C(C=CS2)C(=O)OCC(=O)NC(C)C3CC3)C

Isomeric SMILES

CC1=CC=C(N1C2=C(C=CS2)C(=O)OCC(=O)NC(C)C3CC3)C

InChI

InChI=1S/C18H22N2O3S/c1-11-4-5-12(2)20(11)17-15(8-9-24-17)18(22)23-10-16(21)19-13(3)14-6-7-14/h4-5,8-9,13-14H,6-7,10H2,1-3H3,(H,19,21)