6-[[4-(2,5-dimethylphenyl)piperazin-1-yl]methyl]-2-methylsulfanyl-pyridine-3-carbonitrile

Systemtic Name: 6-[[4-(2,5-dimethylphenyl)piperazin-1-yl]methyl]-2-methylsulfanyl-pyridine-3-carbonitrile Openeye Name: 6-[[4-(2,5-dimethylphenyl)piperazin-1-yl]methyl]-2-methylsulfanyl-pyridine-3-carbonitrile CAS Name: 6-[[4-(2,5-dimethylphenyl)-1-piperazinyl]methyl]-2-(methylthio)-3-pyridinecarbonitrile IUPAC Name: 6-[[4-(2,5-dimethylphenyl)piperazin-1-yl]methyl]-2-methylsulfanylpyridine-3-carbonitrile Traditional Name: 6-[[4-(2,5-dimethylphenyl)piperazino]methyl]-2-(methylthio)nicotinonitrile Formula: C20H24N4S MolecularWeight: 352.49636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)CC3=NC(=C(C=C3)C#N)SC

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)CC3=NC(=C(C=C3)C#N)SC

InChI

InChI=1S/C20H24N4S/c1-15-4-5-16(2)19(12-15)24-10-8-23(9-11-24)14-18-7-6-17(13-21)20(22-18)25-3/h4-7,12H,8-11,14H2,1-3H3