[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]-pyridin-2-yl-methanethiol

Systemtic Name: [5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]-pyridin-2-yl-methanethiol Openeye Name: [5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]-(2-pyridyl)methanethiol CAS Name: [5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]-(2-pyridinyl)methanethiol IUPAC Name: [5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]-pyridin-2-ylmethanethiol Traditional Name: [5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]-(2-pyridyl)methanethiol Formula: C16H16N4OS MolecularWeight: 312.38944

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1C(C2=CC=CC=N2)S)C3=CC=C(C=C3)OC

Isomeric SMILES

CN1C(=NN=C1C(C2=CC=CC=N2)S)C3=CC=C(C=C3)OC

InChI

InChI=1S/C16H16N4OS/c1-20-15(11-6-8-12(21-2)9-7-11)18-19-16(20)14(22)13-5-3-4-10-17-13/h3-10,14,22H,1-2H3