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

Systemtic Name: 1-[[4-(methylsulfonylamino)phenyl]methyl]-3-thiophen-2-yl-indole-2-carboxylic acid Openeye Name: 1-[[4-(methanesulfonamido)phenyl]methyl]-3-(2-thienyl)indole-2-carboxylic acid CAS Name: 1-[[4-(methanesulfonamido)phenyl]methyl]-3-thiophen-2-yl-2-indolecarboxylic acid IUPAC Name: 1-[[4-(methanesulfonamido)phenyl]methyl]-3-thiophen-2-ylindole-2-carboxylic acid Traditional Name: 1-[4-(methanesulfonamido)benzyl]-3-(2-thienyl)indole-2-carboxylic acid Formula: C21H18N2O4S2 MolecularWeight: 426.50862

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)CN2C3=CC=CC=C3C(=C2C(=O)O)C4=CC=CS4

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)CN2C3=CC=CC=C3C(=C2C(=O)O)C4=CC=CS4

InChI

InChI=1S/C21H18N2O4S2/c1-29(26,27)22-15-10-8-14(9-11-15)13-23-17-6-3-2-5-16(17)19(20(23)21(24)25)18-7-4-12-28-18/h2-12,22H,13H2,1H3,(H,24,25)