4-[(4-methyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[(4-methyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[(4-methyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]benzonitrile CAS Name: 4-[[[4-methyl-5-(2-pyrazinyl)-1,2,4-triazol-3-yl]thio]methyl]benzonitrile IUPAC Name: 4-[(4-methyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]benzonitrile Traditional Name: 4-[[(4-methyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)thio]methyl]benzonitrile Formula: C15H12N6S MolecularWeight: 308.36098

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=C(C=C2)C#N)C3=NC=CN=C3

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=C(C=C2)C#N)C3=NC=CN=C3

InChI

InChI=1S/C15H12N6S/c1-21-14(13-9-17-6-7-18-13)19-20-15(21)22-10-12-4-2-11(8-16)3-5-12/h2-7,9H,10H2,1H3