1-[(4-phenylazanylphenyl)methyl]-3-thiophen-2-yl-indole-2-carboxylic acid

Systemtic Name: 1-[(4-phenylazanylphenyl)methyl]-3-thiophen-2-yl-indole-2-carboxylic acid Openeye Name: 1-[(4-anilinophenyl)methyl]-3-(2-thienyl)indole-2-carboxylic acid CAS Name: 1-[(4-anilinophenyl)methyl]-3-thiophen-2-yl-2-indolecarboxylic acid IUPAC Name: 1-[(4-anilinophenyl)methyl]-3-thiophen-2-ylindole-2-carboxylic acid Traditional Name: 1-(4-anilinobenzyl)-3-(2-thienyl)indole-2-carboxylic acid Formula: C26H20N2O2S MolecularWeight: 424.5142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=C(C=C2)CN3C4=CC=CC=C4C(=C3C(=O)O)C5=CC=CS5

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=C(C=C2)CN3C4=CC=CC=C4C(=C3C(=O)O)C5=CC=CS5

InChI

InChI=1S/C26H20N2O2S/c29-26(30)25-24(23-11-6-16-31-23)21-9-4-5-10-22(21)28(25)17-18-12-14-20(15-13-18)27-19-7-2-1-3-8-19/h1-16,27H,17H2,(H,29,30)