N4-(3-bromophenyl)-N7-methyl-6-nitro-quinazoline-4,7-diamine

Systemtic Name: N4-(3-bromophenyl)-N7-methyl-6-nitro-quinazoline-4,7-diamine Openeye Name: N4-(3-bromophenyl)-N7-methyl-6-nitro-quinazoline-4,7-diamine CAS Name: N4-(3-bromophenyl)-N7-methyl-6-nitroquinazoline-4,7-diamine IUPAC Name: 4-N-(3-bromophenyl)-7-N-methyl-6-nitroquinazoline-4,7-diamine Traditional Name: [4-(3-bromoanilino)-6-nitro-quinazolin-7-yl]-methyl-amine Formula: C15H12BrN5O2 MolecularWeight: 374.19208

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=CC=C3)Br)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=CC=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C15H12BrN5O2/c1-17-13-7-12-11(6-14(13)21(22)23)15(19-8-18-12)20-10-4-2-3-9(16)5-10/h2-8,17H,1H3,(H,18,19,20)