N-(2,4-dimethoxyphenyl)-2-[4-(2-nitrophenyl)piperazin-1-yl]quinazolin-4-amine

Systemtic Name: N-(2,4-dimethoxyphenyl)-2-[4-(2-nitrophenyl)piperazin-1-yl]quinazolin-4-amine Openeye Name: N-(2,4-dimethoxyphenyl)-2-[4-(2-nitrophenyl)piperazin-1-yl]quinazolin-4-amine CAS Name: N-(2,4-dimethoxyphenyl)-2-[4-(2-nitrophenyl)-1-piperazinyl]-4-quinazolinamine IUPAC Name: N-(2,4-dimethoxyphenyl)-2-[4-(2-nitrophenyl)piperazin-1-yl]quinazolin-4-amine Traditional Name: (2,4-dimethoxyphenyl)-[2-[4-(2-nitrophenyl)piperazino]quinazolin-4-yl]amine Formula: C26H26N6O4 MolecularWeight: 486.52244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC2=NC(=NC3=CC=CC=C32)N4CCN(CC4)C5=CC=CC=C5[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC2=NC(=NC3=CC=CC=C32)N4CCN(CC4)C5=CC=CC=C5[N+](=O)[O-])OC

InChI

InChI=1S/C26H26N6O4/c1-35-18-11-12-21(24(17-18)36-2)27-25-19-7-3-4-8-20(19)28-26(29-25)31-15-13-30(14-16-31)22-9-5-6-10-23(22)32(33)34/h3-12,17H,13-16H2,1-2H3,(H,27,28,29)