1-(3-methoxy-4-propan-2-yloxy-phenyl)-N-[3-(phenylmethylsulfanyl)-1,2,4-triazol-4-yl]methanimine

Systemtic Name: 1-(3-methoxy-4-propan-2-yloxy-phenyl)-N-[3-(phenylmethylsulfanyl)-1,2,4-triazol-4-yl]methanimine Openeye Name: N-(3-benzylsulfanyl-1,2,4-triazol-4-yl)-1-(4-isopropoxy-3-methoxy-phenyl)methanimine CAS Name: 1-(3-methoxy-4-propan-2-yloxyphenyl)-N-[3-(phenylmethylthio)-1,2,4-triazol-4-yl]methanimine IUPAC Name: N-(3-benzylsulfanyl-1,2,4-triazol-4-yl)-1-(3-methoxy-4-propan-2-yloxyphenyl)methanimine Traditional Name: (E)-[3-(benzylthio)-1,2,4-triazol-4-yl]-(4-isopropoxy-3-methoxy-benzylidene)amine Formula: C20H22N4O2S MolecularWeight: 382.47928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C=NN2C=NN=C2SCC3=CC=CC=C3)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)/C=N/N2C=NN=C2SCC3=CC=CC=C3)OC

InChI

InChI=1S/C20H22N4O2S/c1-15(2)26-18-10-9-17(11-19(18)25-3)12-22-24-14-21-23-20(24)27-13-16-7-5-4-6-8-16/h4-12,14-15H,13H2,1-3H3/b22-12+