3-(oxan-2-ylmethylsulfanyl)-5-pyridin-4-yl-1,2,4-triazol-4-amine

Systemtic Name: 3-(oxan-2-ylmethylsulfanyl)-5-pyridin-4-yl-1,2,4-triazol-4-amine Openeye Name: 3-(4-pyridyl)-5-(tetrahydropyran-2-ylmethylsulfanyl)-1,2,4-triazol-4-amine CAS Name: 3-(2-oxanylmethylthio)-5-pyridin-4-yl-1,2,4-triazol-4-amine IUPAC Name: 3-(oxan-2-ylmethylsulfanyl)-5-pyridin-4-yl-1,2,4-triazol-4-amine Traditional Name: [3-(4-pyridyl)-5-(tetrahydropyran-2-ylmethylthio)-1,2,4-triazol-4-yl]amine Formula: C13H17N5OS MolecularWeight: 291.37198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CSC2=NN=C(N2N)C3=CC=NC=C3

Isomeric SMILES

C1CCOC(C1)CSC2=NN=C(N2N)C3=CC=NC=C3

InChI

InChI=1S/C13H17N5OS/c14-18-12(10-4-6-15-7-5-10)16-17-13(18)20-9-11-3-1-2-8-19-11/h4-7,11H,1-3,8-9,14H2