4-(4-methylphenyl)-4-oxidanylidene-2-(thiophen-2-ylmethylamino)butanoic acid

Systemtic Name: 4-(4-methylphenyl)-4-oxidanylidene-2-(thiophen-2-ylmethylamino)butanoic acid Openeye Name: 4-oxo-4-(p-tolyl)-2-(2-thienylmethylamino)butanoic acid CAS Name: 4-(4-methylphenyl)-4-oxo-2-(thiophen-2-ylmethylamino)butanoic acid IUPAC Name: 4-(4-methylphenyl)-4-oxo-2-(thiophen-2-ylmethylamino)butanoic acid Traditional Name: 4-keto-4-(p-tolyl)-2-(2-thenylamino)butyric acid Formula: C16H17NO3S MolecularWeight: 303.37608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CC(C(=O)O)NCC2=CC=CS2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CC(C(=O)O)NCC2=CC=CS2

InChI

InChI=1S/C16H17NO3S/c1-11-4-6-12(7-5-11)15(18)9-14(16(19)20)17-10-13-3-2-8-21-13/h2-8,14,17H,9-10H2,1H3,(H,19,20)