1-[5-(4-dimethylaminophenyl)thiophen-2-yl]sulfonylindole-2-carboxylic acid

Systemtic Name: 1-[5-(4-dimethylaminophenyl)thiophen-2-yl]sulfonylindole-2-carboxylic acid Openeye Name: 1-[[5-(4-dimethylaminophenyl)-2-thienyl]sulfonyl]indole-2-carboxylic acid CAS Name: 1-[[5-(4-dimethylaminophenyl)-2-thiophenyl]sulfonyl]-2-indolecarboxylic acid IUPAC Name: 1-[5-(4-dimethylaminophenyl)thiophen-2-yl]sulfonylindole-2-carboxylic acid Traditional Name: 1-[[5-(4-dimethylaminophenyl)-2-thienyl]sulfonyl]indole-2-carboxylic acid Formula: C21H18N2O4S2 MolecularWeight: 426.50862

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=CC=C(S2)S(=O)(=O)N3C4=CC=CC=C4C=C3C(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=CC=C(S2)S(=O)(=O)N3C4=CC=CC=C4C=C3C(=O)O

InChI

InChI=1S/C21H18N2O4S2/c1-22(2)16-9-7-14(8-10-16)19-11-12-20(28-19)29(26,27)23-17-6-4-3-5-15(17)13-18(23)21(24)25/h3-13H,1-2H3,(H,24,25)