5-azanylidene-6-(4-methoxyphenyl)-1-(4-methylphenyl)-3-phenyl-pyrrolo[3,4-d]pyridazin-4-amine

Systemtic Name: 5-azanylidene-6-(4-methoxyphenyl)-1-(4-methylphenyl)-3-phenyl-pyrrolo[3,4-d]pyridazin-4-amine Openeye Name: 5-imino-6-(4-methoxyphenyl)-3-phenyl-1-(p-tolyl)pyrrolo[3,4-d]pyridazin-4-amine CAS Name: 5-imino-6-(4-methoxyphenyl)-1-(4-methylphenyl)-3-phenyl-4-pyrrolo[3,4-d]pyridazinamine IUPAC Name: 5-imino-6-(4-methoxyphenyl)-1-(4-methylphenyl)-3-phenylpyrrolo[3,4-d]pyridazin-4-amine Traditional Name: [5-imino-6-(4-methoxyphenyl)-3-phenyl-1-(p-tolyl)pyrrolo[3,4-d]pyridazin-4-yl]amine Formula: C26H23N5O MolecularWeight: 421.49372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=C3C2=CN(C3=N)C4=CC=C(C=C4)OC)N)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=C3C2=CN(C3=N)C4=CC=C(C=C4)OC)N)C5=CC=CC=C5

InChI

InChI=1S/C26H23N5O/c1-17-8-10-18(11-9-17)24-22-16-30(19-12-14-21(32-2)15-13-19)25(27)23(22)26(28)31(29-24)20-6-4-3-5-7-20/h3-16,27H,28H2,1-2H3