7-(4-methylpiperazin-1-yl)-6-nitro-N-(phenylmethyl)quinazolin-4-amine

Systemtic Name: 7-(4-methylpiperazin-1-yl)-6-nitro-N-(phenylmethyl)quinazolin-4-amine Openeye Name: N-benzyl-7-(4-methylpiperazin-1-yl)-6-nitro-quinazolin-4-amine CAS Name: 7-(4-methyl-1-piperazinyl)-6-nitro-N-(phenylmethyl)-4-quinazolinamine IUPAC Name: N-benzyl-7-(4-methylpiperazin-1-yl)-6-nitroquinazolin-4-amine Traditional Name: benzyl-[7-(4-methylpiperazino)-6-nitro-quinazolin-4-yl]amine Formula: C20H22N6O2 MolecularWeight: 378.42768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C3C(=C2)N=CN=C3NCC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C3C(=C2)N=CN=C3NCC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H22N6O2/c1-24-7-9-25(10-8-24)18-12-17-16(11-19(18)26(27)28)20(23-14-22-17)21-13-15-5-3-2-4-6-15/h2-6,11-12,14H,7-10,13H2,1H3,(H,21,22,23)