[4-(2,3-dimethylphenyl)piperazin-1-yl]-(2-propylsulfanylphenyl)methanone

Systemtic Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(2-propylsulfanylphenyl)methanone Openeye Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(2-propylsulfanylphenyl)methanone CAS Name: [4-(2,3-dimethylphenyl)-1-piperazinyl]-[2-(propylthio)phenyl]methanone IUPAC Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(2-propylsulfanylphenyl)methanone Traditional Name: [4-(2,3-dimethylphenyl)piperazino]-[2-(propylthio)phenyl]methanone Formula: C22H28N2OS MolecularWeight: 368.53552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=CC(=C3C)C

Isomeric SMILES

CCCSC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=CC(=C3C)C

InChI

InChI=1S/C22H28N2OS/c1-4-16-26-21-11-6-5-9-19(21)22(25)24-14-12-23(13-15-24)20-10-7-8-17(2)18(20)3/h5-11H,4,12-16H2,1-3H3