4-(7-azanyl-6-nitro-quinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide

Systemtic Name: 4-(7-azanyl-6-nitro-quinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide Openeye Name: 4-(7-amino-6-nitro-quinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide CAS Name: 4-(7-amino-6-nitro-4-quinazolinyl)-N-(4-phenoxyphenyl)-1-piperazinecarboxamide IUPAC Name: 4-(7-amino-6-nitroquinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-(7-amino-6-nitro-quinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide Formula: C25H23N7O4 MolecularWeight: 485.49462

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC3=CC(=C(C=C32)[N+](=O)[O-])N)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=CC(=C(C=C32)[N+](=O)[O-])N)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C25H23N7O4/c26-21-15-22-20(14-23(21)32(34)35)24(28-16-27-22)30-10-12-31(13-11-30)25(33)29-17-6-8-19(9-7-17)36-18-4-2-1-3-5-18/h1-9,14-16H,10-13,26H2,(H,29,33)