4-[[3-methyl-4-(thiophen-2-ylcarbonylamino)phenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-methyl-4-(thiophen-2-ylcarbonylamino)phenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[3-methyl-4-(thiophene-2-carbonylamino)anilino]-4-oxo-butanoic acid CAS Name: 4-[3-methyl-4-[[oxo(thiophen-2-yl)methyl]amino]anilino]-4-oxobutanoic acid IUPAC Name: 4-[3-methyl-4-(thiophene-2-carbonylamino)anilino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[3-methyl-4-(2-thenoylamino)anilino]butyric acid Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CCC(=O)O)NC(=O)C2=CC=CS2

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CCC(=O)O)NC(=O)C2=CC=CS2

InChI

InChI=1S/C16H16N2O4S/c1-10-9-11(17-14(19)6-7-15(20)21)4-5-12(10)18-16(22)13-3-2-8-23-13/h2-5,8-9H,6-7H2,1H3,(H,17,19)(H,18,22)(H,20,21)