1-[(3,4-dichlorophenyl)methyl]-3-[(1-methylimidazol-4-yl)sulfonylamino]indole-2-carboxylic acid

Systemtic Name: 1-[(3,4-dichlorophenyl)methyl]-3-[(1-methylimidazol-4-yl)sulfonylamino]indole-2-carboxylic acid Openeye Name: 1-[(3,4-dichlorophenyl)methyl]-3-[(1-methylimidazol-4-yl)sulfonylamino]indole-2-carboxylic acid CAS Name: 1-[(3,4-dichlorophenyl)methyl]-3-[(1-methyl-4-imidazolyl)sulfonylamino]-2-indolecarboxylic acid IUPAC Name: 1-[(3,4-dichlorophenyl)methyl]-3-[(1-methylimidazol-4-yl)sulfonylamino]indole-2-carboxylic acid Traditional Name: 1-(3,4-dichlorobenzyl)-3-[(1-methylimidazol-4-yl)sulfonylamino]indole-2-carboxylic acid Formula: C20H16Cl2N4O4S MolecularWeight: 479.33644

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1)S(=O)(=O)NC2=C(N(C3=CC=CC=C32)CC4=CC(=C(C=C4)Cl)Cl)C(=O)O

Isomeric SMILES

CN1C=C(N=C1)S(=O)(=O)NC2=C(N(C3=CC=CC=C32)CC4=CC(=C(C=C4)Cl)Cl)C(=O)O

InChI

InChI=1S/C20H16Cl2N4O4S/c1-25-10-17(23-11-25)31(29,30)24-18-13-4-2-3-5-16(13)26(19(18)20(27)28)9-12-6-7-14(21)15(22)8-12/h2-8,10-11,24H,9H2,1H3,(H,27,28)