1-(4-methylsulfanyl-2-propyl-phenyl)-3-(phenylmethyl)piperazine

Systemtic Name: 1-(4-methylsulfanyl-2-propyl-phenyl)-3-(phenylmethyl)piperazine Openeye Name: 3-benzyl-1-(4-methylsulfanyl-2-propyl-phenyl)piperazine CAS Name: 1-[4-(methylthio)-2-propylphenyl]-3-(phenylmethyl)piperazine IUPAC Name: 3-benzyl-1-(4-methylsulfanyl-2-propylphenyl)piperazine Traditional Name: 3-benzyl-1-[4-(methylthio)-2-propyl-phenyl]piperazine Formula: C21H28N2S MolecularWeight: 340.52542

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)SC)N2CCNC(C2)CC3=CC=CC=C3

Isomeric SMILES

CCCC1=C(C=CC(=C1)SC)N2CCNC(C2)CC3=CC=CC=C3

InChI

InChI=1S/C21H28N2S/c1-3-7-18-15-20(24-2)10-11-21(18)23-13-12-22-19(16-23)14-17-8-5-4-6-9-17/h4-6,8-11,15,19,22H,3,7,12-14,16H2,1-2H3