N-(3-bromophenyl)-7-(3-imidazol-1-ylpropoxy)-6-nitro-quinazolin-4-amine

Systemtic Name: N-(3-bromophenyl)-7-(3-imidazol-1-ylpropoxy)-6-nitro-quinazolin-4-amine Openeye Name: N-(3-bromophenyl)-7-(3-imidazol-1-ylpropoxy)-6-nitro-quinazolin-4-amine CAS Name: N-(3-bromophenyl)-7-[3-(1-imidazolyl)propoxy]-6-nitro-4-quinazolinamine IUPAC Name: N-(3-bromophenyl)-7-(3-imidazol-1-ylpropoxy)-6-nitroquinazolin-4-amine Traditional Name: (3-bromophenyl)-[7-(3-imidazol-1-ylpropoxy)-6-nitro-quinazolin-4-yl]amine Formula: C20H17BrN6O3 MolecularWeight: 469.29138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)NC2=NC=NC3=CC(=C(C=C32)[N+](=O)[O-])OCCCN4C=CN=C4

Isomeric SMILES

C1=CC(=CC(=C1)Br)NC2=NC=NC3=CC(=C(C=C32)[N+](=O)[O-])OCCCN4C=CN=C4

InChI

InChI=1S/C20H17BrN6O3/c21-14-3-1-4-15(9-14)25-20-16-10-18(27(28)29)19(11-17(16)23-12-24-20)30-8-2-6-26-7-5-22-13-26/h1,3-5,7,9-13H,2,6,8H2,(H,23,24,25)