[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-[2-(naphthalen-1-ylmethylsulfanyl)phenyl]methanone

Systemtic Name: [4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-[2-(naphthalen-1-ylmethylsulfanyl)phenyl]methanone Openeye Name: [4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-[2-(1-naphthylmethylsulfanyl)phenyl]methanone CAS Name: [4-[(4-tert-butylphenyl)methyl]-1-piperazinyl]-[2-(1-naphthalenylmethylthio)phenyl]methanone IUPAC Name: [4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-[2-(naphthalen-1-ylmethylsulfanyl)phenyl]methanone Traditional Name: [4-(4-tert-butylbenzyl)piperazino]-[2-(1-naphthylmethylthio)phenyl]methanone Formula: C33H36N2OS MolecularWeight: 508.71674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC=CC=C3SCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC=CC=C3SCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C33H36N2OS/c1-33(2,3)28-17-15-25(16-18-28)23-34-19-21-35(22-20-34)32(36)30-13-6-7-14-31(30)37-24-27-11-8-10-26-9-4-5-12-29(26)27/h4-18H,19-24H2,1-3H3