2-[[4-(2-methoxyethyl)-5-pyrazin-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanenitrile

Systemtic Name: 2-[[4-(2-methoxyethyl)-5-pyrazin-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanenitrile Openeye Name: 2-[[4-(2-methoxyethyl)-5-pyrazin-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetonitrile CAS Name: 2-[[4-(2-methoxyethyl)-5-(2-pyrazinyl)-1,2,4-triazol-3-yl]thio]acetonitrile IUPAC Name: 2-[[4-(2-methoxyethyl)-5-pyrazin-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetonitrile Traditional Name: 2-[[4-(2-methoxyethyl)-5-pyrazin-2-yl-1,2,4-triazol-3-yl]thio]acetonitrile Formula: C11H12N6OS MolecularWeight: 276.31758

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=NN=C1SCC#N)C2=NC=CN=C2

Isomeric SMILES

COCCN1C(=NN=C1SCC#N)C2=NC=CN=C2

InChI

InChI=1S/C11H12N6OS/c1-18-6-5-17-10(9-8-13-3-4-14-9)15-16-11(17)19-7-2-12/h3-4,8H,5-7H2,1H3