5-[4-[1H-indazol-5-yl-(phenylmethyl)amino]quinazolin-6-yl]-1-methyl-pyrrole-2-carbaldehyde

Systemtic Name: 5-[4-[1H-indazol-5-yl-(phenylmethyl)amino]quinazolin-6-yl]-1-methyl-pyrrole-2-carbaldehyde Openeye Name: 5-[4-[benzyl(1H-indazol-5-yl)amino]quinazolin-6-yl]-1-methyl-pyrrole-2-carbaldehyde CAS Name: 5-[4-[1H-indazol-5-yl-(phenylmethyl)amino]-6-quinazolinyl]-1-methyl-2-pyrrolecarboxaldehyde IUPAC Name: 5-[4-[benzyl(1H-indazol-5-yl)amino]quinazolin-6-yl]-1-methylpyrrole-2-carbaldehyde Traditional Name: 5-[4-[benzyl(1H-indazol-5-yl)amino]quinazolin-6-yl]-1-methyl-pyrrole-2-carbaldehyde Formula: C28H22N6O MolecularWeight: 458.51388

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1C2=CC3=C(C=C2)N=CN=C3N(CC4=CC=CC=C4)C5=CC6=C(C=C5)NN=C6)C=O

Isomeric SMILES

CN1C(=CC=C1C2=CC3=C(C=C2)N=CN=C3N(CC4=CC=CC=C4)C5=CC6=C(C=C5)NN=C6)C=O

InChI

InChI=1S/C28H22N6O/c1-33-23(17-35)9-12-27(33)20-7-10-26-24(14-20)28(30-18-29-26)34(16-19-5-3-2-4-6-19)22-8-11-25-21(13-22)15-31-32-25/h2-15,17-18H,16H2,1H3,(H,31,32)