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

Systemtic Name: 1-[(3,4-dichlorophenyl)methyl]-4-[(1-methylimidazol-4-yl)sulfonylamino]indole-2-carboxylic acid Openeye Name: 1-[(3,4-dichlorophenyl)methyl]-4-[(1-methylimidazol-4-yl)sulfonylamino]indole-2-carboxylic acid CAS Name: 1-[(3,4-dichlorophenyl)methyl]-4-[(1-methyl-4-imidazolyl)sulfonylamino]-2-indolecarboxylic acid IUPAC Name: 1-[(3,4-dichlorophenyl)methyl]-4-[(1-methylimidazol-4-yl)sulfonylamino]indole-2-carboxylic acid Traditional Name: 1-(3,4-dichlorobenzyl)-4-[(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=CC=CC3=C2C=C(N3CC4=CC(=C(C=C4)Cl)Cl)C(=O)O

Isomeric SMILES

CN1C=C(N=C1)S(=O)(=O)NC2=CC=CC3=C2C=C(N3CC4=CC(=C(C=C4)Cl)Cl)C(=O)O

InChI

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