4-[4-(2-cyclopentylethyl)-1,3-oxazol-2-yl]-N-[4-[2-[(2-oxidanyl-2-pyridin-3-yl-ethyl)amino]ethyl]phenyl]benzenesulfonamide

Systemtic Name: 4-[4-(2-cyclopentylethyl)-1,3-oxazol-2-yl]-N-[4-[2-[(2-oxidanyl-2-pyridin-3-yl-ethyl)amino]ethyl]phenyl]benzenesulfonamide Openeye Name: 4-[4-(2-cyclopentylethyl)oxazol-2-yl]-N-[4-[2-[[2-hydroxy-2-(3-pyridyl)ethyl]amino]ethyl]phenyl]benzenesulfonamide CAS Name: 4-[4-(2-cyclopentylethyl)-2-oxazolyl]-N-[4-[2-[[2-hydroxy-2-(3-pyridinyl)ethyl]amino]ethyl]phenyl]benzenesulfonamide IUPAC Name: 4-[4-(2-cyclopentylethyl)-1,3-oxazol-2-yl]-N-[4-[2-[(2-hydroxy-2-pyridin-3-ylethyl)amino]ethyl]phenyl]benzenesulfonamide Traditional Name: 4-[4-(2-cyclopentylethyl)oxazol-2-yl]-N-[4-[2-[[2-hydroxy-2-(3-pyridyl)ethyl]amino]ethyl]phenyl]benzenesulfonamide Formula: C31H36N4O4S MolecularWeight: 560.70694

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC2=COC(=N2)C3=CC=C(C=C3)S(=O)(=O)NC4=CC=C(C=C4)CCNCC(C5=CN=CC=C5)O

Isomeric SMILES

C1CCC(C1)CCC2=COC(=N2)C3=CC=C(C=C3)S(=O)(=O)NC4=CC=C(C=C4)CCNCC(C5=CN=CC=C5)O

InChI

InChI=1S/C31H36N4O4S/c36-30(26-6-3-18-32-20-26)21-33-19-17-24-7-12-27(13-8-24)35-40(37,38)29-15-10-25(11-16-29)31-34-28(22-39-31)14-9-23-4-1-2-5-23/h3,6-8,10-13,15-16,18,20,22-23,30,33,35-36H,1-2,4-5,9,14,17,19,21H2