4-oxidanylidene-4-[[3-(thiophen-2-ylcarbonylamino)phenyl]amino]butanoate

Systemtic Name: 4-oxidanylidene-4-[[3-(thiophen-2-ylcarbonylamino)phenyl]amino]butanoate Openeye Name: 4-oxo-4-[3-(thiophene-2-carbonylamino)anilino]butanoate CAS Name: 4-oxo-4-[3-[[oxo(thiophen-2-yl)methyl]amino]anilino]butanoate IUPAC Name: 4-oxo-4-[3-(thiophene-2-carbonylamino)anilino]butanoate Traditional Name: 4-keto-4-[3-(2-thenoylamino)anilino]butyrate Formula: C15H13N2O4S- MolecularWeight: 317.33972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCC(=O)[O-])NC(=O)C2=CC=CS2

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCC(=O)[O-])NC(=O)C2=CC=CS2

InChI

InChI=1S/C15H14N2O4S/c18-13(6-7-14(19)20)16-10-3-1-4-11(9-10)17-15(21)12-5-2-8-22-12/h1-5,8-9H,6-7H2,(H,16,18)(H,17,21)(H,19,20)/p-1