[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-(2-methyl-5-methylsulfanyl-phenyl)methanone

Systemtic Name: [4-[(3-chlorophenyl)methyl]piperazin-1-yl]-(2-methyl-5-methylsulfanyl-phenyl)methanone Openeye Name: [4-[(3-chlorophenyl)methyl]piperazin-1-yl]-(2-methyl-5-methylsulfanyl-phenyl)methanone CAS Name: [4-[(3-chlorophenyl)methyl]-1-piperazinyl]-[2-methyl-5-(methylthio)phenyl]methanone IUPAC Name: [4-[(3-chlorophenyl)methyl]piperazin-1-yl]-(2-methyl-5-methylsulfanylphenyl)methanone Traditional Name: [4-(3-chlorobenzyl)piperazino]-[2-methyl-5-(methylthio)phenyl]methanone Formula: C20H23ClN2OS MolecularWeight: 374.92742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC)C(=O)N2CCN(CC2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)SC)C(=O)N2CCN(CC2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H23ClN2OS/c1-15-6-7-18(25-2)13-19(15)20(24)23-10-8-22(9-11-23)14-16-4-3-5-17(21)12-16/h3-7,12-13H,8-11,14H2,1-2H3