N-[3-[1-[[4-(4-tert-butylphenyl)sulfanylphenyl]methyl]piperidin-4-yl]-4-methyl-phenyl]-2-methyl-propanamide

Systemtic Name: N-[3-[1-[[4-(4-tert-butylphenyl)sulfanylphenyl]methyl]piperidin-4-yl]-4-methyl-phenyl]-2-methyl-propanamide Openeye Name: N-[3-[1-[[4-(4-tert-butylphenyl)sulfanylphenyl]methyl]-4-piperidyl]-4-methyl-phenyl]-2-methyl-propanamide CAS Name: N-[3-[1-[[4-[(4-tert-butylphenyl)thio]phenyl]methyl]-4-piperidinyl]-4-methylphenyl]-2-methylpropanamide IUPAC Name: N-[3-[1-[[4-(4-tert-butylphenyl)sulfanylphenyl]methyl]piperidin-4-yl]-4-methylphenyl]-2-methylpropanamide Traditional Name: N-[3-[1-[4-[(4-tert-butylphenyl)thio]benzyl]-4-piperidyl]-4-methyl-phenyl]-2-methyl-propionamide Formula: C33H42N2OS MolecularWeight: 514.76438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)C)C2CCN(CC2)CC3=CC=C(C=C3)SC4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)C)C2CCN(CC2)CC3=CC=C(C=C3)SC4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C33H42N2OS/c1-23(2)32(36)34-28-12-7-24(3)31(21-28)26-17-19-35(20-18-26)22-25-8-13-29(14-9-25)37-30-15-10-27(11-16-30)33(4,5)6/h7-16,21,23,26H,17-20,22H2,1-6H3,(H,34,36)