3-[2-(4-chlorophenyl)sulfanylphenyl]-N-(6-methyl-6-oxidanyl-heptan-2-yl)propanamide

Systemtic Name: 3-[2-(4-chlorophenyl)sulfanylphenyl]-N-(6-methyl-6-oxidanyl-heptan-2-yl)propanamide Openeye Name: 3-[2-(4-chlorophenyl)sulfanylphenyl]-N-(5-hydroxy-1,5-dimethyl-hexyl)propanamide CAS Name: 3-[2-[(4-chlorophenyl)thio]phenyl]-N-(6-hydroxy-6-methylheptan-2-yl)propanamide IUPAC Name: 3-[2-(4-chlorophenyl)sulfanylphenyl]-N-(6-hydroxy-6-methylheptan-2-yl)propanamide Traditional Name: 3-[2-[(4-chlorophenyl)thio]phenyl]-N-(5-hydroxy-1,5-dimethyl-hexyl)propionamide Formula: C23H30ClNO2S MolecularWeight: 420.0078

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(C)(C)O)NC(=O)CCC1=CC=CC=C1SC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(CCCC(C)(C)O)NC(=O)CCC1=CC=CC=C1SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C23H30ClNO2S/c1-17(7-6-16-23(2,3)27)25-22(26)15-10-18-8-4-5-9-21(18)28-20-13-11-19(24)12-14-20/h4-5,8-9,11-14,17,27H,6-7,10,15-16H2,1-3H3,(H,25,26)