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

Systemtic Name: N-methyl-2-(4-oxidanyl-3,5-diphenyl-phenyl)sulfanyl-N-(2-pyridin-4-ylethyl)propanamide Openeye Name: 2-(4-hydroxy-3,5-diphenyl-phenyl)sulfanyl-N-methyl-N-[2-(4-pyridyl)ethyl]propanamide CAS Name: 2-[(4-hydroxy-3,5-diphenylphenyl)thio]-N-methyl-N-(2-pyridin-4-ylethyl)propanamide IUPAC Name: 2-(4-hydroxy-3,5-diphenylphenyl)sulfanyl-N-methyl-N-(2-pyridin-4-ylethyl)propanamide Traditional Name: 2-[(4-hydroxy-3,5-diphenyl-phenyl)thio]-N-methyl-N-[2-(4-pyridyl)ethyl]propionamide Formula: C29H28N2O2S MolecularWeight: 468.60982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(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/C29H28N2O2S/c1-21(29(33)31(2)18-15-22-13-16-30-17-14-22)34-25-19-26(23-9-5-3-6-10-23)28(32)27(20-25)24-11-7-4-8-12-24/h3-14,16-17,19-21,32H,15,18H2,1-2H3