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

Systemtic Name: 4-(4-methoxyphenyl)-3-methylsulfanyl-5-(phenylmethyl)-1,2,4-triazole Openeye Name: 3-benzyl-4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazole CAS Name: 4-(4-methoxyphenyl)-3-(methylthio)-5-(phenylmethyl)-1,2,4-triazole IUPAC Name: 3-benzyl-4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazole Traditional Name: 3-benzyl-4-(4-methoxyphenyl)-5-(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)N2C(=NN=C2SC)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=C2SC)CC3=CC=CC=C3

InChI

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