2-methylsulfanyl-6-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]pyridine-3-carbonitrile

Systemtic Name: 2-methylsulfanyl-6-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]pyridine-3-carbonitrile Openeye Name: 2-methylsulfanyl-6-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]pyridine-3-carbonitrile CAS Name: 2-(methylthio)-6-[[4-(2-pyrazinyl)-1-piperazinyl]methyl]-3-pyridinecarbonitrile IUPAC Name: 2-methylsulfanyl-6-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]pyridine-3-carbonitrile Traditional Name: 2-(methylthio)-6-[(4-pyrazin-2-ylpiperazino)methyl]nicotinonitrile Formula: C16H18N6S MolecularWeight: 326.41932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N6S/c1-23-16-13(10-17)2-3-14(20-16)12-21-6-8-22(9-7-21)15-11-18-4-5-19-15/h2-5,11H,6-9,12H2,1H3