2-[[5-ethanoyl-4-methyl-3-[(phenylmethyl)carbamoyl]thiophen-2-yl]amino]ethanoic acid

Systemtic Name: 2-[[5-ethanoyl-4-methyl-3-[(phenylmethyl)carbamoyl]thiophen-2-yl]amino]ethanoic acid Openeye Name: 2-[[5-acetyl-3-(benzylcarbamoyl)-4-methyl-2-thienyl]amino]acetic acid CAS Name: 2-[[5-acetyl-4-methyl-3-[oxo-[(phenylmethyl)amino]methyl]-2-thiophenyl]amino]acetic acid IUPAC Name: 2-[[5-acetyl-3-(benzylcarbamoyl)-4-methylthiophen-2-yl]amino]acetic acid Traditional Name: 2-[[5-acetyl-3-(benzylcarbamoyl)-4-methyl-2-thienyl]amino]acetic acid Formula: C17H18N2O4S MolecularWeight: 346.40082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)NCC2=CC=CC=C2)NCC(=O)O)C(=O)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)NCC2=CC=CC=C2)NCC(=O)O)C(=O)C

InChI

InChI=1S/C17H18N2O4S/c1-10-14(16(23)18-8-12-6-4-3-5-7-12)17(19-9-13(21)22)24-15(10)11(2)20/h3-7,19H,8-9H2,1-2H3,(H,18,23)(H,21,22)