2-(3-methyl-2-sulfanylidene-1,3-diazinan-1-yl)pyridine-3-carbonitrile

Systemtic Name: 2-(3-methyl-2-sulfanylidene-1,3-diazinan-1-yl)pyridine-3-carbonitrile Openeye Name: 2-(3-methyl-2-thioxo-hexahydropyrimidin-1-yl)pyridine-3-carbonitrile CAS Name: 2-(3-methyl-2-sulfanylidene-1,3-diazinan-1-yl)-3-pyridinecarbonitrile IUPAC Name: 2-(3-methyl-2-sulfanylidene-1,3-diazinan-1-yl)pyridine-3-carbonitrile Traditional Name: 2-(3-methyl-2-thioxo-hexahydropyrimidin-1-yl)nicotinonitrile Formula: C11H12N4S MolecularWeight: 232.30478

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(C1=S)C2=C(C=CC=N2)C#N

Isomeric SMILES

CN1CCCN(C1=S)C2=C(C=CC=N2)C#N

InChI

InChI=1S/C11H12N4S/c1-14-6-3-7-15(11(14)16)10-9(8-12)4-2-5-13-10/h2,4-5H,3,6-7H2,1H3