4-(4-methoxyphenyl)-N-[1-(2-methylphenyl)benzimidazol-5-yl]phthalazin-1-amine

Systemtic Name: 4-(4-methoxyphenyl)-N-[1-(2-methylphenyl)benzimidazol-5-yl]phthalazin-1-amine Openeye Name: 4-(4-methoxyphenyl)-N-[1-(o-tolyl)benzimidazol-5-yl]phthalazin-1-amine CAS Name: 4-(4-methoxyphenyl)-N-[1-(2-methylphenyl)-5-benzimidazolyl]-1-phthalazinamine IUPAC Name: 4-(4-methoxyphenyl)-N-[1-(2-methylphenyl)benzimidazol-5-yl]phthalazin-1-amine Traditional Name: [4-(4-methoxyphenyl)phthalazin-1-yl]-[1-(o-tolyl)benzimidazol-5-yl]amine Formula: C29H23N5O MolecularWeight: 457.52582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=NC3=C2C=CC(=C3)NC4=NN=C(C5=CC=CC=C54)C6=CC=C(C=C6)OC

Isomeric SMILES

CC1=CC=CC=C1N2C=NC3=C2C=CC(=C3)NC4=NN=C(C5=CC=CC=C54)C6=CC=C(C=C6)OC

InChI

InChI=1S/C29H23N5O/c1-19-7-3-6-10-26(19)34-18-30-25-17-21(13-16-27(25)34)31-29-24-9-5-4-8-23(24)28(32-33-29)20-11-14-22(35-2)15-12-20/h3-18H,1-2H3,(H,31,33)