3-[3-[(3-tert-butyl-4-oxidanyl-octyl)sulfanylmethyl]phenyl]-N-(4-phenylazanylphenyl)propanamide

Systemtic Name: 3-[3-[(3-tert-butyl-4-oxidanyl-octyl)sulfanylmethyl]phenyl]-N-(4-phenylazanylphenyl)propanamide Openeye Name: N-(4-anilinophenyl)-3-[3-[(3-tert-butyl-4-hydroxy-octyl)sulfanylmethyl]phenyl]propanamide CAS Name: N-(4-anilinophenyl)-3-[3-[[(3-tert-butyl-4-hydroxyoctyl)thio]methyl]phenyl]propanamide IUPAC Name: N-(4-anilinophenyl)-3-[3-[(3-tert-butyl-4-hydroxyoctyl)sulfanylmethyl]phenyl]propanamide Traditional Name: N-(4-anilinophenyl)-3-[3-[[(3-tert-butyl-4-hydroxy-octyl)thio]methyl]phenyl]propionamide Formula: C34H46N2O2S MolecularWeight: 546.80624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(CCSCC1=CC=CC(=C1)CCC(=O)NC2=CC=C(C=C2)NC3=CC=CC=C3)C(C)(C)C)O

Isomeric SMILES

CCCCC(C(CCSCC1=CC=CC(=C1)CCC(=O)NC2=CC=C(C=C2)NC3=CC=CC=C3)C(C)(C)C)O

InChI

InChI=1S/C34H46N2O2S/c1-5-6-15-32(37)31(34(2,3)4)22-23-39-25-27-12-10-11-26(24-27)16-21-33(38)36-30-19-17-29(18-20-30)35-28-13-8-7-9-14-28/h7-14,17-20,24,31-32,35,37H,5-6,15-16,21-23,25H2,1-4H3,(H,36,38)