6-[[4-(3,4-dichlorophenyl)piperazin-1-yl]methyl]-2-methylsulfanyl-pyridine-3-carbonitrile

Systemtic Name: 6-[[4-(3,4-dichlorophenyl)piperazin-1-yl]methyl]-2-methylsulfanyl-pyridine-3-carbonitrile Openeye Name: 6-[[4-(3,4-dichlorophenyl)piperazin-1-yl]methyl]-2-methylsulfanyl-pyridine-3-carbonitrile CAS Name: 6-[[4-(3,4-dichlorophenyl)-1-piperazinyl]methyl]-2-(methylthio)-3-pyridinecarbonitrile IUPAC Name: 6-[[4-(3,4-dichlorophenyl)piperazin-1-yl]methyl]-2-methylsulfanylpyridine-3-carbonitrile Traditional Name: 6-[[4-(3,4-dichlorophenyl)piperazino]methyl]-2-(methylthio)nicotinonitrile Formula: C18H18Cl2N4S MolecularWeight: 393.33332

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC(=N1)CN2CCN(CC2)C3=CC(=C(C=C3)Cl)Cl)C#N

Isomeric SMILES

CSC1=C(C=CC(=N1)CN2CCN(CC2)C3=CC(=C(C=C3)Cl)Cl)C#N

InChI

InChI=1S/C18H18Cl2N4S/c1-25-18-13(11-21)2-3-14(22-18)12-23-6-8-24(9-7-23)15-4-5-16(19)17(20)10-15/h2-5,10H,6-9,12H2,1H3