3-(4-methylsulfanylphenyl)-1-[4-(phenylmethyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: 3-(4-methylsulfanylphenyl)-1-[4-(phenylmethyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-3-(4-methylsulfanylphenyl)prop-2-en-1-one CAS Name: 3-[4-(methylthio)phenyl]-1-[4-(phenylmethyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: 1-(4-benzylpiperazin-1-yl)-3-(4-methylsulfanylphenyl)prop-2-en-1-one Traditional Name: 1-(4-benzylpiperazino)-3-[4-(methylthio)phenyl]prop-2-en-1-one Formula: C21H24N2OS MolecularWeight: 352.49306

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=CC(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CSC1=CC=C(C=C1)C=CC(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H24N2OS/c1-25-20-10-7-18(8-11-20)9-12-21(24)23-15-13-22(14-16-23)17-19-5-3-2-4-6-19/h2-12H,13-17H2,1H3