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

Systemtic Name: 3-(3-chlorophenyl)-5-(oxan-2-ylmethylsulfanyl)-1,2,4-triazol-4-amine Openeye Name: 3-(3-chlorophenyl)-5-(tetrahydropyran-2-ylmethylsulfanyl)-1,2,4-triazol-4-amine CAS Name: 3-(3-chlorophenyl)-5-(2-oxanylmethylthio)-1,2,4-triazol-4-amine IUPAC Name: 3-(3-chlorophenyl)-5-(oxan-2-ylmethylsulfanyl)-1,2,4-triazol-4-amine Traditional Name: [3-(3-chlorophenyl)-5-(tetrahydropyran-2-ylmethylthio)-1,2,4-triazol-4-yl]amine Formula: C14H17ClN4OS MolecularWeight: 324.82898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17ClN4OS/c15-11-5-3-4-10(8-11)13-17-18-14(19(13)16)21-9-12-6-1-2-7-20-12/h3-5,8,12H,1-2,6-7,9,16H2