1-[(2-tert-butylsulfanylphenyl)methyl]-4-[(2,4-dichlorophenyl)methyl]piperazine

Systemtic Name: 1-[(2-tert-butylsulfanylphenyl)methyl]-4-[(2,4-dichlorophenyl)methyl]piperazine Openeye Name: 1-[(2-tert-butylsulfanylphenyl)methyl]-4-[(2,4-dichlorophenyl)methyl]piperazine CAS Name: 1-[[2-(tert-butylthio)phenyl]methyl]-4-[(2,4-dichlorophenyl)methyl]piperazine IUPAC Name: 1-[(2-tert-butylsulfanylphenyl)methyl]-4-[(2,4-dichlorophenyl)methyl]piperazine Traditional Name: 1-[2-(tert-butylthio)benzyl]-4-(2,4-dichlorobenzyl)piperazine Formula: C22H28Cl2N2S MolecularWeight: 423.44212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC1=CC=CC=C1CN2CCN(CC2)CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C)(C)SC1=CC=CC=C1CN2CCN(CC2)CC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H28Cl2N2S/c1-22(2,3)27-21-7-5-4-6-18(21)16-26-12-10-25(11-13-26)15-17-8-9-19(23)14-20(17)24/h4-9,14H,10-13,15-16H2,1-3H3