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

Systemtic Name: N-[2-(4-methylphenyl)ethyl]-6-nitro-7-piperazin-1-yl-quinazolin-2-amine Openeye Name: 6-nitro-7-piperazin-1-yl-N-[2-(p-tolyl)ethyl]quinazolin-2-amine CAS Name: N-[2-(4-methylphenyl)ethyl]-6-nitro-7-(1-piperazinyl)-2-quinazolinamine IUPAC Name: N-[2-(4-methylphenyl)ethyl]-6-nitro-7-piperazin-1-ylquinazolin-2-amine Traditional Name: (6-nitro-7-piperazino-quinazolin-2-yl)-[2-(p-tolyl)ethyl]amine Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCNC2=NC3=CC(=C(C=C3C=N2)[N+](=O)[O-])N4CCNCC4

Isomeric SMILES

CC1=CC=C(C=C1)CCNC2=NC3=CC(=C(C=C3C=N2)[N+](=O)[O-])N4CCNCC4

InChI

InChI=1S/C21H24N6O2/c1-15-2-4-16(5-3-15)6-7-23-21-24-14-17-12-20(27(28)29)19(13-18(17)25-21)26-10-8-22-9-11-26/h2-5,12-14,22H,6-11H2,1H3,(H,23,24,25)