2-(4-methyl-2-pyrrol-1-yl-phenyl)sulfanyl-2-phenyl-ethanoic acid

Systemtic Name: 2-(4-methyl-2-pyrrol-1-yl-phenyl)sulfanyl-2-phenyl-ethanoic acid Openeye Name: 2-(4-methyl-2-pyrrol-1-yl-phenyl)sulfanyl-2-phenyl-acetic acid CAS Name: 2-[[4-methyl-2-(1-pyrrolyl)phenyl]thio]-2-phenylacetic acid IUPAC Name: 2-(4-methyl-2-pyrrol-1-ylphenyl)sulfanyl-2-phenylacetic acid Traditional Name: 2-[(4-methyl-2-pyrrol-1-yl-phenyl)thio]-2-phenyl-acetic acid Formula: C19H17NO2S MolecularWeight: 323.40878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SC(C2=CC=CC=C2)C(=O)O)N3C=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)SC(C2=CC=CC=C2)C(=O)O)N3C=CC=C3

InChI

InChI=1S/C19H17NO2S/c1-14-9-10-17(16(13-14)20-11-5-6-12-20)23-18(19(21)22)15-7-3-2-4-8-15/h2-13,18H,1H3,(H,21,22)