N-(3-bromophenyl)-7-[3-(4-methylpiperazin-1-yl)propoxy]-6-nitro-quinazolin-4-amine

Systemtic Name: N-(3-bromophenyl)-7-[3-(4-methylpiperazin-1-yl)propoxy]-6-nitro-quinazolin-4-amine Openeye Name: N-(3-bromophenyl)-7-[3-(4-methylpiperazin-1-yl)propoxy]-6-nitro-quinazolin-4-amine CAS Name: N-(3-bromophenyl)-7-[3-(4-methyl-1-piperazinyl)propoxy]-6-nitro-4-quinazolinamine IUPAC Name: N-(3-bromophenyl)-7-[3-(4-methylpiperazin-1-yl)propoxy]-6-nitroquinazolin-4-amine Traditional Name: (3-bromophenyl)-[7-[3-(4-methylpiperazino)propoxy]-6-nitro-quinazolin-4-yl]amine Formula: C22H25BrN6O3 MolecularWeight: 501.3763

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCOC2=C(C=C3C(=C2)N=CN=C3NC4=CC(=CC=C4)Br)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)CCCOC2=C(C=C3C(=C2)N=CN=C3NC4=CC(=CC=C4)Br)[N+](=O)[O-]

InChI

InChI=1S/C22H25BrN6O3/c1-27-7-9-28(10-8-27)6-3-11-32-21-14-19-18(13-20(21)29(30)31)22(25-15-24-19)26-17-5-2-4-16(23)12-17/h2,4-5,12-15H,3,6-11H2,1H3,(H,24,25,26)