2-(3-methyl-2-pyrrol-1-yl-phenyl)sulfanyl-2-phenyl-ethanoic acid

Systemtic Name: 2-(3-methyl-2-pyrrol-1-yl-phenyl)sulfanyl-2-phenyl-ethanoic acid Openeye Name: 2-(3-methyl-2-pyrrol-1-yl-phenyl)sulfanyl-2-phenyl-acetic acid CAS Name: 2-[[3-methyl-2-(1-pyrrolyl)phenyl]thio]-2-phenylacetic acid IUPAC Name: 2-(3-methyl-2-pyrrol-1-ylphenyl)sulfanyl-2-phenylacetic acid Traditional Name: 2-[(3-methyl-2-pyrrol-1-yl-phenyl)thio]-2-phenyl-acetic acid Formula: C19H17NO2S MolecularWeight: 323.40878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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