N-(4-methoxyphenyl)-3-(pyridin-4-ylmethylsulfanyl)-1H-1,2,4-triazol-5-amine

Systemtic Name: N-(4-methoxyphenyl)-3-(pyridin-4-ylmethylsulfanyl)-1H-1,2,4-triazol-5-amine Openeye Name: N-(4-methoxyphenyl)-3-(4-pyridylmethylsulfanyl)-1H-1,2,4-triazol-5-amine CAS Name: N-(4-methoxyphenyl)-3-(pyridin-4-ylmethylthio)-1H-1,2,4-triazol-5-amine IUPAC Name: N-(4-methoxyphenyl)-3-(pyridin-4-ylmethylsulfanyl)-1H-1,2,4-triazol-5-amine Traditional Name: (4-methoxyphenyl)-[3-(4-pyridylmethylthio)-1H-1,2,4-triazol-5-yl]amine Formula: C15H15N5OS MolecularWeight: 313.3775

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC(=NN2)SCC3=CC=NC=C3

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC(=NN2)SCC3=CC=NC=C3

InChI

InChI=1S/C15H15N5OS/c1-21-13-4-2-12(3-5-13)17-14-18-15(20-19-14)22-10-11-6-8-16-9-7-11/h2-9H,10H2,1H3,(H2,17,18,19,20)