4-[(3-methoxycarbonyl-4,5-dimethyl-thiophen-2-yl)amino]-4-oxidanylidene-2-phenyl-butanoic acid

Systemtic Name: 4-[(3-methoxycarbonyl-4,5-dimethyl-thiophen-2-yl)amino]-4-oxidanylidene-2-phenyl-butanoic acid Openeye Name: 4-[(3-methoxycarbonyl-4,5-dimethyl-2-thienyl)amino]-4-oxo-2-phenyl-butanoic acid CAS Name: 4-[(3-methoxycarbonyl-4,5-dimethyl-2-thiophenyl)amino]-4-oxo-2-phenylbutanoic acid IUPAC Name: 4-[(3-methoxycarbonyl-4,5-dimethylthiophen-2-yl)amino]-4-oxo-2-phenylbutanoic acid Traditional Name: 4-[(3-carbomethoxy-4,5-dimethyl-2-thienyl)amino]-4-keto-2-phenyl-butyric acid Formula: C18H19NO5S MolecularWeight: 361.41216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CC(C2=CC=CC=C2)C(=O)O)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CC(C2=CC=CC=C2)C(=O)O)C

InChI

InChI=1S/C18H19NO5S/c1-10-11(2)25-16(15(10)18(23)24-3)19-14(20)9-13(17(21)22)12-7-5-4-6-8-12/h4-8,13H,9H2,1-3H3,(H,19,20)(H,21,22)