1-(4-butoxyphenyl)-N-[3-(phenylmethylsulfanyl)-1,2,4-triazol-4-yl]methanimine

Systemtic Name: 1-(4-butoxyphenyl)-N-[3-(phenylmethylsulfanyl)-1,2,4-triazol-4-yl]methanimine Openeye Name: N-(3-benzylsulfanyl-1,2,4-triazol-4-yl)-1-(4-butoxyphenyl)methanimine CAS Name: 1-(4-butoxyphenyl)-N-[3-(phenylmethylthio)-1,2,4-triazol-4-yl]methanimine IUPAC Name: N-(3-benzylsulfanyl-1,2,4-triazol-4-yl)-1-(4-butoxyphenyl)methanimine Traditional Name: (E)-[3-(benzylthio)-1,2,4-triazol-4-yl]-(4-butoxybenzylidene)amine Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=NN2C=NN=C2SCC3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=N/N2C=NN=C2SCC3=CC=CC=C3

InChI

InChI=1S/C20H22N4OS/c1-2-3-13-25-19-11-9-17(10-12-19)14-22-24-16-21-23-20(24)26-15-18-7-5-4-6-8-18/h4-12,14,16H,2-3,13,15H2,1H3/b22-14+