2-[(2-chlorophenyl)methylsulfanyl]-2-methyl-N-[1-(4-methyl-3-oxidanyl-phenyl)butan-2-yl]propanamide

Systemtic Name: 2-[(2-chlorophenyl)methylsulfanyl]-2-methyl-N-[1-(4-methyl-3-oxidanyl-phenyl)butan-2-yl]propanamide Openeye Name: 2-[(2-chlorophenyl)methylsulfanyl]-N-[1-[(3-hydroxy-4-methyl-phenyl)methyl]propyl]-2-methyl-propanamide CAS Name: 2-[(2-chlorophenyl)methylthio]-N-[1-(3-hydroxy-4-methylphenyl)butan-2-yl]-2-methylpropanamide IUPAC Name: 2-[(2-chlorophenyl)methylsulfanyl]-N-[1-(3-hydroxy-4-methylphenyl)butan-2-yl]-2-methylpropanamide Traditional Name: 2-[(2-chlorobenzyl)thio]-N-[1-(3-hydroxy-4-methyl-benzyl)propyl]-2-methyl-propionamide Formula: C22H28ClNO2S MolecularWeight: 405.98122

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC(=C(C=C1)C)O)NC(=O)C(C)(C)SCC2=CC=CC=C2Cl

Isomeric SMILES

CCC(CC1=CC(=C(C=C1)C)O)NC(=O)C(C)(C)SCC2=CC=CC=C2Cl

InChI

InChI=1S/C22H28ClNO2S/c1-5-18(12-16-11-10-15(2)20(25)13-16)24-21(26)22(3,4)27-14-17-8-6-7-9-19(17)23/h6-11,13,18,25H,5,12,14H2,1-4H3,(H,24,26)