N-methyl-2-(4-oxidanyl-3,5-diphenyl-phenyl)sulfanyl-N-(2-pyridin-4-ylethyl)pentanamide

Systemtic Name: N-methyl-2-(4-oxidanyl-3,5-diphenyl-phenyl)sulfanyl-N-(2-pyridin-4-ylethyl)pentanamide Openeye Name: 2-(4-hydroxy-3,5-diphenyl-phenyl)sulfanyl-N-methyl-N-[2-(4-pyridyl)ethyl]pentanamide CAS Name: 2-[(4-hydroxy-3,5-diphenylphenyl)thio]-N-methyl-N-(2-pyridin-4-ylethyl)pentanamide IUPAC Name: 2-(4-hydroxy-3,5-diphenylphenyl)sulfanyl-N-methyl-N-(2-pyridin-4-ylethyl)pentanamide Traditional Name: 2-[(4-hydroxy-3,5-diphenyl-phenyl)thio]-N-methyl-N-[2-(4-pyridyl)ethyl]valeramide Formula: C31H32N2O2S MolecularWeight: 496.66298

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)N(C)CCC1=CC=NC=C1)SC2=CC(=C(C(=C2)C3=CC=CC=C3)O)C4=CC=CC=C4

Isomeric SMILES

CCCC(C(=O)N(C)CCC1=CC=NC=C1)SC2=CC(=C(C(=C2)C3=CC=CC=C3)O)C4=CC=CC=C4

InChI

InChI=1S/C31H32N2O2S/c1-3-10-29(31(35)33(2)20-17-23-15-18-32-19-16-23)36-26-21-27(24-11-6-4-7-12-24)30(34)28(22-26)25-13-8-5-9-14-25/h4-9,11-16,18-19,21-22,29,34H,3,10,17,20H2,1-2H3