2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanenitrile

Systemtic Name: 2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanenitrile Openeye Name: 2-[[5-(2-thienylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetonitrile CAS Name: 2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]thio]acetonitrile IUPAC Name: 2-[[5-(thiophen-2-ylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetonitrile Traditional Name: 2-[[5-(2-thenyl)-1H-1,2,4-triazol-3-yl]thio]acetonitrile Formula: C9H8N4S2 MolecularWeight: 236.31662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CC2=NC(=NN2)SCC#N

Isomeric SMILES

C1=CSC(=C1)CC2=NC(=NN2)SCC#N

InChI

InChI=1S/C9H8N4S2/c10-3-5-15-9-11-8(12-13-9)6-7-2-1-4-14-7/h1-2,4H,5-6H2,(H,11,12,13)