N-ethyl-6-nitro-4-(4-phenylpiperazin-1-yl)quinazolin-7-amine

Systemtic Name: N-ethyl-6-nitro-4-(4-phenylpiperazin-1-yl)quinazolin-7-amine Openeye Name: N-ethyl-6-nitro-4-(4-phenylpiperazin-1-yl)quinazolin-7-amine CAS Name: N-ethyl-6-nitro-4-(4-phenyl-1-piperazinyl)-7-quinazolinamine IUPAC Name: N-ethyl-6-nitro-4-(4-phenylpiperazin-1-yl)quinazolin-7-amine Traditional Name: ethyl-[6-nitro-4-(4-phenylpiperazino)quinazolin-7-yl]amine Formula: C20H22N6O2 MolecularWeight: 378.42768

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C2C(=C1)N=CN=C2N3CCN(CC3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C2C(=C1)N=CN=C2N3CCN(CC3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H22N6O2/c1-2-21-18-13-17-16(12-19(18)26(27)28)20(23-14-22-17)25-10-8-24(9-11-25)15-6-4-3-5-7-15/h3-7,12-14,21H,2,8-11H2,1H3