5-(4-methoxyphenyl)-3-methylsulfanyl-1-(phenylmethyl)-1,2,4-triazole

Systemtic Name: 5-(4-methoxyphenyl)-3-methylsulfanyl-1-(phenylmethyl)-1,2,4-triazole Openeye Name: 1-benzyl-5-(4-methoxyphenyl)-3-methylsulfanyl-1,2,4-triazole CAS Name: 5-(4-methoxyphenyl)-3-(methylthio)-1-(phenylmethyl)-1,2,4-triazole IUPAC Name: 1-benzyl-5-(4-methoxyphenyl)-3-methylsulfanyl-1,2,4-triazole Traditional Name: 1-benzyl-5-(4-methoxyphenyl)-3-(methylthio)-1,2,4-triazole Formula: C17H17N3OS MolecularWeight: 311.40138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=NN2CC3=CC=CC=C3)SC

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=NN2CC3=CC=CC=C3)SC

InChI

InChI=1S/C17H17N3OS/c1-21-15-10-8-14(9-11-15)16-18-17(22-2)19-20(16)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3