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

Systemtic Name: 1-(3-methoxy-4-propan-2-yloxy-phenyl)-N-[3-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazol-4-yl]methanimine Openeye Name: 1-(4-isopropoxy-3-methoxy-phenyl)-N-[3-(p-tolylmethylsulfanyl)-1,2,4-triazol-4-yl]methanimine CAS Name: 1-(3-methoxy-4-propan-2-yloxyphenyl)-N-[3-[(4-methylphenyl)methylthio]-1,2,4-triazol-4-yl]methanimine IUPAC Name: 1-(3-methoxy-4-propan-2-yloxyphenyl)-N-[3-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazol-4-yl]methanimine Traditional Name: (E)-(4-isopropoxy-3-methoxy-benzylidene)-[3-[(4-methylbenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=CN2N=CC3=CC(=C(C=C3)OC(C)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=CN2/N=C/C3=CC(=C(C=C3)OC(C)C)OC

InChI

InChI=1S/C21H24N4O2S/c1-15(2)27-19-10-9-18(11-20(19)26-4)12-23-25-14-22-24-21(25)28-13-17-7-5-16(3)6-8-17/h5-12,14-15H,13H2,1-4H3/b23-12+