N-[3-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-4-yl]-1-(4-propan-2-yloxyphenyl)methanimine

Systemtic Name: N-[3-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-4-yl]-1-(4-propan-2-yloxyphenyl)methanimine Openeye Name: N-(3-benzylsulfanyl-5-methyl-1,2,4-triazol-4-yl)-1-(4-isopropoxyphenyl)methanimine CAS Name: N-[3-methyl-5-(phenylmethylthio)-1,2,4-triazol-4-yl]-1-(4-propan-2-yloxyphenyl)methanimine IUPAC Name: N-(3-benzylsulfanyl-5-methyl-1,2,4-triazol-4-yl)-1-(4-propan-2-yloxyphenyl)methanimine Traditional Name: (E)-[3-(benzylthio)-5-methyl-1,2,4-triazol-4-yl]-(4-isopropoxybenzylidene)amine Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1N=CC2=CC=C(C=C2)OC(C)C)SCC3=CC=CC=C3

Isomeric SMILES

CC1=NN=C(N1/N=C/C2=CC=C(C=C2)OC(C)C)SCC3=CC=CC=C3

InChI

InChI=1S/C20H22N4OS/c1-15(2)25-19-11-9-17(10-12-19)13-21-24-16(3)22-23-20(24)26-14-18-7-5-4-6-8-18/h4-13,15H,14H2,1-3H3/b21-13+