4-[[3-(cyclopropylcarbamoyl)-4-(4-methylphenyl)thiophen-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-(cyclopropylcarbamoyl)-4-(4-methylphenyl)thiophen-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[3-(cyclopropylcarbamoyl)-4-(p-tolyl)-2-thienyl]amino]-4-oxo-butanoic acid CAS Name: 4-[[3-[(cyclopropylamino)-oxomethyl]-4-(4-methylphenyl)-2-thiophenyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[3-(cyclopropylcarbamoyl)-4-(4-methylphenyl)thiophen-2-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[3-(cyclopropylcarbamoyl)-4-(p-tolyl)-2-thienyl]amino]-4-keto-butyric acid Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)NC3CC3)NC(=O)CCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)NC3CC3)NC(=O)CCC(=O)O

InChI

InChI=1S/C19H20N2O4S/c1-11-2-4-12(5-3-11)14-10-26-19(21-15(22)8-9-16(23)24)17(14)18(25)20-13-6-7-13/h2-5,10,13H,6-9H2,1H3,(H,20,25)(H,21,22)(H,23,24)