1-[(3,4-dichlorophenyl)methyl]-4-[(5-pyridin-2-ylthiophen-2-yl)sulfonylamino]indole-2-carboxylic acid

Systemtic Name: 1-[(3,4-dichlorophenyl)methyl]-4-[(5-pyridin-2-ylthiophen-2-yl)sulfonylamino]indole-2-carboxylic acid Openeye Name: 1-[(3,4-dichlorophenyl)methyl]-4-[[5-(2-pyridyl)-2-thienyl]sulfonylamino]indole-2-carboxylic acid CAS Name: 1-[(3,4-dichlorophenyl)methyl]-4-[[5-(2-pyridinyl)-2-thiophenyl]sulfonylamino]-2-indolecarboxylic acid IUPAC Name: 1-[(3,4-dichlorophenyl)methyl]-4-[(5-pyridin-2-ylthiophen-2-yl)sulfonylamino]indole-2-carboxylic acid Traditional Name: 1-(3,4-dichlorobenzyl)-4-[[5-(2-pyridyl)-2-thienyl]sulfonylamino]indole-2-carboxylic acid Formula: C25H17Cl2N3O4S2 MolecularWeight: 558.45618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=CC=C(S2)S(=O)(=O)NC3=CC=CC4=C3C=C(N4CC5=CC(=C(C=C5)Cl)Cl)C(=O)O

Isomeric SMILES

C1=CC=NC(=C1)C2=CC=C(S2)S(=O)(=O)NC3=CC=CC4=C3C=C(N4CC5=CC(=C(C=C5)Cl)Cl)C(=O)O

InChI

InChI=1S/C25H17Cl2N3O4S2/c26-17-8-7-15(12-18(17)27)14-30-21-6-3-5-19(16(21)13-22(30)25(31)32)29-36(33,34)24-10-9-23(35-24)20-4-1-2-11-28-20/h1-13,29H,14H2,(H,31,32)