2-[2-(1-methylimidazol-2-yl)sulfanylethylamino]pyridine-3-carbonitrile

Systemtic Name: 2-[2-(1-methylimidazol-2-yl)sulfanylethylamino]pyridine-3-carbonitrile Openeye Name: 2-[2-(1-methylimidazol-2-yl)sulfanylethylamino]pyridine-3-carbonitrile CAS Name: 2-[2-[(1-methyl-2-imidazolyl)thio]ethylamino]-3-pyridinecarbonitrile IUPAC Name: 2-[2-(1-methylimidazol-2-yl)sulfanylethylamino]pyridine-3-carbonitrile Traditional Name: 2-[2-[(1-methylimidazol-2-yl)thio]ethylamino]nicotinonitrile Formula: C12H13N5S MolecularWeight: 259.33012

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCCNC2=C(C=CC=N2)C#N

Isomeric SMILES

CN1C=CN=C1SCCNC2=C(C=CC=N2)C#N

InChI

InChI=1S/C12H13N5S/c1-17-7-5-16-12(17)18-8-6-15-11-10(9-13)3-2-4-14-11/h2-5,7H,6,8H2,1H3,(H,14,15)