4-(4-ethoxyphenyl)-3-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 4-(4-ethoxyphenyl)-3-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-4-(4-ethoxyphenyl)-5-methyl-1,2,4-triazole CAS Name: 4-(4-ethoxyphenyl)-3-methyl-5-(phenylmethylthio)-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-4-(4-ethoxyphenyl)-5-methyl-1,2,4-triazole Traditional Name: 3-(benzylthio)-5-methyl-4-p-phenetyl-1,2,4-triazole Formula: C18H19N3OS MolecularWeight: 325.42796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3)C

InChI

InChI=1S/C18H19N3OS/c1-3-22-17-11-9-16(10-12-17)21-14(2)19-20-18(21)23-13-15-7-5-4-6-8-15/h4-12H,3,13H2,1-2H3