4-(2,2-dimethoxyethyl)-3-phenyl-5-(phenylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 4-(2,2-dimethoxyethyl)-3-phenyl-5-(phenylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-4-(2,2-dimethoxyethyl)-5-phenyl-1,2,4-triazole CAS Name: 4-(2,2-dimethoxyethyl)-3-phenyl-5-(phenylmethylthio)-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-4-(2,2-dimethoxyethyl)-5-phenyl-1,2,4-triazole Traditional Name: 3-(benzylthio)-4-(2,2-dimethoxyethyl)-5-phenyl-1,2,4-triazole Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

COC(CN1C(=NN=C1SCC2=CC=CC=C2)C3=CC=CC=C3)OC

Isomeric SMILES

COC(CN1C(=NN=C1SCC2=CC=CC=C2)C3=CC=CC=C3)OC

InChI

InChI=1S/C19H21N3O2S/c1-23-17(24-2)13-22-18(16-11-7-4-8-12-16)20-21-19(22)25-14-15-9-5-3-6-10-15/h3-12,17H,13-14H2,1-2H3