4-[2-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethoxy]benzenecarbonitrile Openeye Name: 4-[2-[[4-methyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]ethoxy]benzonitrile CAS Name: 4-[2-[[4-methyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]ethoxy]benzonitrile IUPAC Name: 4-[2-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethoxy]benzonitrile Traditional Name: 4-[2-[[4-methyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]ethoxy]benzonitrile Formula: C17H15N5OS MolecularWeight: 337.3989

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCOC2=CC=C(C=C2)C#N)C3=CN=CC=C3

Isomeric SMILES

CN1C(=NN=C1SCCOC2=CC=C(C=C2)C#N)C3=CN=CC=C3

InChI

InChI=1S/C17H15N5OS/c1-22-16(14-3-2-8-19-12-14)20-21-17(22)24-10-9-23-15-6-4-13(11-18)5-7-15/h2-8,12H,9-10H2,1H3