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

Systemtic Name: 3-[5-(2-methoxyethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]benzenecarbonitrile Openeye Name: 3-[5-(2-methoxyethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]benzonitrile CAS Name: 3-[5-(2-methoxyethylthio)-4-methyl-1,2,4-triazol-3-yl]benzonitrile IUPAC Name: 3-[5-(2-methoxyethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]benzonitrile Traditional Name: 3-[5-(2-methoxyethylthio)-4-methyl-1,2,4-triazol-3-yl]benzonitrile Formula: C13H14N4OS MolecularWeight: 274.34146

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCOC)C2=CC=CC(=C2)C#N

Isomeric SMILES

CN1C(=NN=C1SCCOC)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C13H14N4OS/c1-17-12(11-5-3-4-10(8-11)9-14)15-16-13(17)19-7-6-18-2/h3-5,8H,6-7H2,1-2H3