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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C2=NC(=NN2)SCC3=CC=CC=C3

Isomeric SMILES

CCCOC1=CC=CC=C1C2=NC(=NN2)SCC3=CC=CC=C3

InChI

InChI=1S/C18H19N3OS/c1-2-12-22-16-11-7-6-10-15(16)17-19-18(21-20-17)23-13-14-8-4-3-5-9-14/h3-11H,2,12-13H2,1H3,(H,19,20,21)