2-[[5-[(E)-2-thiophen-2-ylethenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile

Systemtic Name: 2-[[5-[(E)-2-thiophen-2-ylethenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile Openeye Name: 2-[[5-[(E)-2-(2-thienyl)vinyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile CAS Name: 2-[[5-[(E)-2-thiophen-2-ylethenyl]-1H-1,2,4-triazol-3-yl]thio]-3-pyridinecarbonitrile IUPAC Name: 2-[[5-[(E)-2-thiophen-2-ylethenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]pyridine-3-carbonitrile Traditional Name: 2-[[5-[(E)-2-(2-thienyl)vinyl]-1H-1,2,4-triazol-3-yl]thio]nicotinonitrile Formula: C14H9N5S2 MolecularWeight: 311.38476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SC2=NNC(=N2)C=CC3=CC=CS3)C#N

Isomeric SMILES

C1=CC(=C(N=C1)SC2=NNC(=N2)/C=C/C3=CC=CS3)C#N

InChI

InChI=1S/C14H9N5S2/c15-9-10-3-1-7-16-13(10)21-14-17-12(18-19-14)6-5-11-4-2-8-20-11/h1-8H,(H,17,18,19)/b6-5+