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

Systemtic Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[3-(methylsulfanylmethyl)phenyl]methanone Openeye Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[3-(methylsulfanylmethyl)phenyl]methanone CAS Name: [4-(2,3-dimethylphenyl)-1-piperazinyl]-[3-[(methylthio)methyl]phenyl]methanone IUPAC Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[3-(methylsulfanylmethyl)phenyl]methanone Traditional Name: [4-(2,3-dimethylphenyl)piperazino]-[3-[(methylthio)methyl]phenyl]methanone Formula: C21H26N2OS MolecularWeight: 354.50894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)CSC)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)CSC)C

InChI

InChI=1S/C21H26N2OS/c1-16-6-4-9-20(17(16)2)22-10-12-23(13-11-22)21(24)19-8-5-7-18(14-19)15-25-3/h4-9,14H,10-13,15H2,1-3H3