2-(4-methoxyphenyl)-2-(2-pyrrol-1-ylphenyl)sulfanyl-ethanoic acid

Systemtic Name: 2-(4-methoxyphenyl)-2-(2-pyrrol-1-ylphenyl)sulfanyl-ethanoic acid Openeye Name: 2-(4-methoxyphenyl)-2-(2-pyrrol-1-ylphenyl)sulfanyl-acetic acid CAS Name: 2-(4-methoxyphenyl)-2-[[2-(1-pyrrolyl)phenyl]thio]acetic acid IUPAC Name: 2-(4-methoxyphenyl)-2-(2-pyrrol-1-ylphenyl)sulfanylacetic acid Traditional Name: 2-(4-methoxyphenyl)-2-[(2-pyrrol-1-ylphenyl)thio]acetic acid Formula: C19H17NO3S MolecularWeight: 339.40818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C(=O)O)SC2=CC=CC=C2N3C=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(C(=O)O)SC2=CC=CC=C2N3C=CC=C3

InChI

InChI=1S/C19H17NO3S/c1-23-15-10-8-14(9-11-15)18(19(21)22)24-17-7-3-2-6-16(17)20-12-4-5-13-20/h2-13,18H,1H3,(H,21,22)