3-[(2-methylphenyl)methylsulfanyl]-1-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[(2-methylphenyl)methylsulfanyl]-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: 3-(o-tolylmethylsulfanyl)-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: 3-[(2-methylphenyl)methylthio]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: 3-[(2-methylphenyl)methylsulfanyl]-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: 3-[(2-methylbenzyl)thio]-1-(4-phenylpiperazino)propan-1-one Formula: C21H26N2OS MolecularWeight: 354.50894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSCCC(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1CSCCC(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H26N2OS/c1-18-7-5-6-8-19(18)17-25-16-11-21(24)23-14-12-22(13-15-23)20-9-3-2-4-10-20/h2-10H,11-17H2,1H3