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

Systemtic Name: 2-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanenitrile Openeye Name: 2-[[4-methyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetonitrile CAS Name: 2-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]acetonitrile IUPAC Name: 2-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetonitrile Traditional Name: 2-[[4-methyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]acetonitrile Formula: C10H10N4S2 MolecularWeight: 250.3432

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC#N)CC2=CC=CS2

Isomeric SMILES

CN1C(=NN=C1SCC#N)CC2=CC=CS2

InChI

InChI=1S/C10H10N4S2/c1-14-9(7-8-3-2-5-15-8)12-13-10(14)16-6-4-11/h2-3,5H,6-7H2,1H3