1-(phenylmethyl)-4-[(5-pyridin-2-ylthiophen-2-yl)sulfonylamino]indole-2-carboxylic acid

Systemtic Name: 1-(phenylmethyl)-4-[(5-pyridin-2-ylthiophen-2-yl)sulfonylamino]indole-2-carboxylic acid Openeye Name: 1-benzyl-4-[[5-(2-pyridyl)-2-thienyl]sulfonylamino]indole-2-carboxylic acid CAS Name: 1-(phenylmethyl)-4-[[5-(2-pyridinyl)-2-thiophenyl]sulfonylamino]-2-indolecarboxylic acid IUPAC Name: 1-benzyl-4-[(5-pyridin-2-ylthiophen-2-yl)sulfonylamino]indole-2-carboxylic acid Traditional Name: 1-benzyl-4-[[5-(2-pyridyl)-2-thienyl]sulfonylamino]indole-2-carboxylic acid Formula: C25H19N3O4S2 MolecularWeight: 489.56606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=C2C(=O)O)C(=CC=C3)NS(=O)(=O)C4=CC=C(S4)C5=CC=CC=N5

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=C2C(=O)O)C(=CC=C3)NS(=O)(=O)C4=CC=C(S4)C5=CC=CC=N5

InChI

InChI=1S/C25H19N3O4S2/c29-25(30)22-15-18-19(10-6-11-21(18)28(22)16-17-7-2-1-3-8-17)27-34(31,32)24-13-12-23(33-24)20-9-4-5-14-26-20/h1-15,27H,16H2,(H,29,30)