N-[2-(3-fluorophenyl)ethyl]-6-nitro-7-piperazin-1-yl-quinazolin-2-amine

Systemtic Name: N-[2-(3-fluorophenyl)ethyl]-6-nitro-7-piperazin-1-yl-quinazolin-2-amine Openeye Name: N-[2-(3-fluorophenyl)ethyl]-6-nitro-7-piperazin-1-yl-quinazolin-2-amine CAS Name: N-[2-(3-fluorophenyl)ethyl]-6-nitro-7-(1-piperazinyl)-2-quinazolinamine IUPAC Name: N-[2-(3-fluorophenyl)ethyl]-6-nitro-7-piperazin-1-ylquinazolin-2-amine Traditional Name: 2-(3-fluorophenyl)ethyl-(6-nitro-7-piperazino-quinazolin-2-yl)amine Formula: C20H21FN6O2 MolecularWeight: 396.418143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21FN6O2/c21-16-3-1-2-14(10-16)4-5-23-20-24-13-15-11-19(27(28)29)18(12-17(15)25-20)26-8-6-22-7-9-26/h1-3,10-13,22H,4-9H2,(H,23,24,25)