1-(4-methylsulfanylphenyl)-3-[4-(phenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 1-(4-methylsulfanylphenyl)-3-[4-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(4-benzylpiperazin-1-yl)-1-(4-methylsulfanylphenyl)propan-1-one CAS Name: 1-[4-(methylthio)phenyl]-3-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-benzylpiperazin-1-yl)-1-(4-methylsulfanylphenyl)propan-1-one Traditional Name: 3-(4-benzylpiperazino)-1-[4-(methylthio)phenyl]propan-1-one Formula: C21H26N2OS MolecularWeight: 354.50894

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)CCN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)CCN2CCN(CC2)CC3=CC=CC=C3

InChI

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