N-[2-(4-bromophenyl)ethyl]-6-nitro-7-piperazin-1-yl-quinazolin-2-amine

Systemtic Name: N-[2-(4-bromophenyl)ethyl]-6-nitro-7-piperazin-1-yl-quinazolin-2-amine Openeye Name: N-[2-(4-bromophenyl)ethyl]-6-nitro-7-piperazin-1-yl-quinazolin-2-amine CAS Name: N-[2-(4-bromophenyl)ethyl]-6-nitro-7-(1-piperazinyl)-2-quinazolinamine IUPAC Name: N-[2-(4-bromophenyl)ethyl]-6-nitro-7-piperazin-1-ylquinazolin-2-amine Traditional Name: 2-(4-bromophenyl)ethyl-(6-nitro-7-piperazino-quinazolin-2-yl)amine Formula: C20H21BrN6O2 MolecularWeight: 457.32374

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C3C=NC(=NC3=C2)NCCC4=CC=C(C=C4)Br)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2=C(C=C3C=NC(=NC3=C2)NCCC4=CC=C(C=C4)Br)[N+](=O)[O-]

InChI

InChI=1S/C20H21BrN6O2/c21-16-3-1-14(2-4-16)5-6-23-20-24-13-15-11-19(27(28)29)18(12-17(15)25-20)26-9-7-22-8-10-26/h1-4,11-13,22H,5-10H2,(H,23,24,25)