6-[[ethyl(2-pyridin-2-ylethyl)amino]methyl]-2-methylsulfanyl-pyridine-3-carbonitrile

Systemtic Name: 6-[[ethyl(2-pyridin-2-ylethyl)amino]methyl]-2-methylsulfanyl-pyridine-3-carbonitrile Openeye Name: 6-[[ethyl-[2-(2-pyridyl)ethyl]amino]methyl]-2-methylsulfanyl-pyridine-3-carbonitrile CAS Name: 6-[[ethyl-[2-(2-pyridinyl)ethyl]amino]methyl]-2-(methylthio)-3-pyridinecarbonitrile IUPAC Name: 6-[[ethyl(2-pyridin-2-ylethyl)amino]methyl]-2-methylsulfanylpyridine-3-carbonitrile Traditional Name: 6-[[ethyl-[2-(2-pyridyl)ethyl]amino]methyl]-2-(methylthio)nicotinonitrile Formula: C17H20N4S MolecularWeight: 312.4325

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC1=CC=CC=N1)CC2=NC(=C(C=C2)C#N)SC

Isomeric SMILES

CCN(CCC1=CC=CC=N1)CC2=NC(=C(C=C2)C#N)SC

InChI

InChI=1S/C17H20N4S/c1-3-21(11-9-15-6-4-5-10-19-15)13-16-8-7-14(12-18)17(20-16)22-2/h4-8,10H,3,9,11,13H2,1-2H3