5-(2-methoxyphenyl)-3-(phenylmethylsulfanyl)-1H-1,2,4-triazole

Systemtic Name: 5-(2-methoxyphenyl)-3-(phenylmethylsulfanyl)-1H-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-5-(2-methoxyphenyl)-1H-1,2,4-triazole CAS Name: 5-(2-methoxyphenyl)-3-(phenylmethylthio)-1H-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-5-(2-methoxyphenyl)-1H-1,2,4-triazole Traditional Name: 3-(benzylthio)-5-(2-methoxyphenyl)-1H-1,2,4-triazole Formula: C16H15N3OS MolecularWeight: 297.3748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NC(=NN2)SCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1C2=NC(=NN2)SCC3=CC=CC=C3

InChI

InChI=1S/C16H15N3OS/c1-20-14-10-6-5-9-13(14)15-17-16(19-18-15)21-11-12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,17,18,19)