4-[4-(3-cyclopentylpropyl)-5-oxidanylidene-1,2,4-triazol-1-yl]-N-[4-[2-[(2-oxidanyl-2-pyridin-3-yl-ethyl)amino]ethyl]phenyl]benzenesulfonamide

Systemtic Name: 4-[4-(3-cyclopentylpropyl)-5-oxidanylidene-1,2,4-triazol-1-yl]-N-[4-[2-[(2-oxidanyl-2-pyridin-3-yl-ethyl)amino]ethyl]phenyl]benzenesulfonamide Openeye Name: 4-[4-(3-cyclopentylpropyl)-5-oxo-1,2,4-triazol-1-yl]-N-[4-[2-[[2-hydroxy-2-(3-pyridyl)ethyl]amino]ethyl]phenyl]benzenesulfonamide CAS Name: 4-[4-(3-cyclopentylpropyl)-5-oxo-1,2,4-triazol-1-yl]-N-[4-[2-[[2-hydroxy-2-(3-pyridinyl)ethyl]amino]ethyl]phenyl]benzenesulfonamide IUPAC Name: 4-[4-(3-cyclopentylpropyl)-5-oxo-1,2,4-triazol-1-yl]-N-[4-[2-[(2-hydroxy-2-pyridin-3-ylethyl)amino]ethyl]phenyl]benzenesulfonamide Traditional Name: 4-[4-(3-cyclopentylpropyl)-5-keto-1,2,4-triazol-1-yl]-N-[4-[2-[[2-hydroxy-2-(3-pyridyl)ethyl]amino]ethyl]phenyl]benzenesulfonamide Formula: C31H38N6O4S MolecularWeight: 590.73622

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCCN2C=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)NC4=CC=C(C=C4)CCNCC(C5=CN=CC=C5)O

Isomeric SMILES

C1CCC(C1)CCCN2C=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)NC4=CC=C(C=C4)CCNCC(C5=CN=CC=C5)O

InChI

InChI=1S/C31H38N6O4S/c38-30(26-8-3-18-32-21-26)22-33-19-17-25-9-11-27(12-10-25)35-42(40,41)29-15-13-28(14-16-29)37-31(39)36(23-34-37)20-4-7-24-5-1-2-6-24/h3,8-16,18,21,23-24,30,33,35,38H,1-2,4-7,17,19-20,22H2