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

Systemtic Name: 2-[(4-phenyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]pyridine-3-carbonitrile Openeye Name: 2-[[4-phenyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile CAS Name: 2-[[4-phenyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-3-pyridinecarbonitrile IUPAC Name: 2-[(4-phenyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]pyridine-3-carbonitrile Traditional Name: 2-[[4-phenyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]nicotinonitrile Formula: C19H12N6S MolecularWeight: 356.40378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SC3=C(C=CC=N3)C#N)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SC3=C(C=CC=N3)C#N)C4=CN=CC=C4

InChI

InChI=1S/C19H12N6S/c20-12-14-6-5-11-22-18(14)26-19-24-23-17(15-7-4-10-21-13-15)25(19)16-8-2-1-3-9-16/h1-11,13H