2-phenyl-2-[2-(pyrrol-1-ylmethyl)phenyl]sulfanyl-ethanoic acid

Systemtic Name: 2-phenyl-2-[2-(pyrrol-1-ylmethyl)phenyl]sulfanyl-ethanoic acid Openeye Name: 2-phenyl-2-[2-(pyrrol-1-ylmethyl)phenyl]sulfanyl-acetic acid CAS Name: 2-phenyl-2-[[2-(1-pyrrolylmethyl)phenyl]thio]acetic acid IUPAC Name: 2-phenyl-2-[2-(pyrrol-1-ylmethyl)phenyl]sulfanylacetic acid Traditional Name: 2-phenyl-2-[[2-(pyrrol-1-ylmethyl)phenyl]thio]acetic acid Formula: C19H17NO2S MolecularWeight: 323.40878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)O)SC2=CC=CC=C2CN3C=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)O)SC2=CC=CC=C2CN3C=CC=C3

InChI

InChI=1S/C19H17NO2S/c21-19(22)18(15-8-2-1-3-9-15)23-17-11-5-4-10-16(17)14-20-12-6-7-13-20/h1-13,18H,14H2,(H,21,22)