6-nitro-N-phenethyl-7-piperazin-1-yl-quinazolin-4-amine

Systemtic Name: 6-nitro-N-phenethyl-7-piperazin-1-yl-quinazolin-4-amine Openeye Name: 6-nitro-N-phenethyl-7-piperazin-1-yl-quinazolin-4-amine CAS Name: 6-nitro-N-phenethyl-7-(1-piperazinyl)-4-quinazolinamine IUPAC Name: 6-nitro-N-phenethyl-7-piperazin-1-ylquinazolin-4-amine Traditional Name: (6-nitro-7-piperazino-quinazolin-4-yl)-phenethyl-amine Formula: C20H22N6O2 MolecularWeight: 378.42768

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C3C(=C2)N=CN=C3NCCC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2=C(C=C3C(=C2)N=CN=C3NCCC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H22N6O2/c27-26(28)19-12-16-17(13-18(19)25-10-8-21-9-11-25)23-14-24-20(16)22-7-6-15-4-2-1-3-5-15/h1-5,12-14,21H,6-11H2,(H,22,23,24)