6-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]pyridine-3-carbonitrile

Systemtic Name: 6-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]pyridine-3-carbonitrile Openeye Name: 6-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile CAS Name: 6-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-3-pyridinecarbonitrile IUPAC Name: 6-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]pyridine-3-carbonitrile Traditional Name: 6-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]nicotinonitrile Formula: C14H10N6S MolecularWeight: 294.3344

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC2=NC=C(C=C2)C#N)C3=CC=NC=C3

Isomeric SMILES

CN1C(=NN=C1SC2=NC=C(C=C2)C#N)C3=CC=NC=C3

InChI

InChI=1S/C14H10N6S/c1-20-13(11-4-6-16-7-5-11)18-19-14(20)21-12-3-2-10(8-15)9-17-12/h2-7,9H,1H3