N7-ethyl-6-nitro-N4-[[4-(propylamino)phenyl]methyl]quinazoline-4,7-diamine

Systemtic Name: N7-ethyl-6-nitro-N4-[[4-(propylamino)phenyl]methyl]quinazoline-4,7-diamine Openeye Name: N7-ethyl-6-nitro-N4-[[4-(propylamino)phenyl]methyl]quinazoline-4,7-diamine CAS Name: N7-ethyl-6-nitro-N4-[[4-(propylamino)phenyl]methyl]quinazoline-4,7-diamine IUPAC Name: 7-N-ethyl-6-nitro-4-N-[[4-(propylamino)phenyl]methyl]quinazoline-4,7-diamine Traditional Name: ethyl-[6-nitro-4-[[4-(propylamino)benzyl]amino]quinazolin-7-yl]amine Formula: C20H24N6O2 MolecularWeight: 380.44356

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=CC=C(C=C1)CNC2=NC=NC3=CC(=C(C=C32)[N+](=O)[O-])NCC

Isomeric SMILES

CCCNC1=CC=C(C=C1)CNC2=NC=NC3=CC(=C(C=C32)[N+](=O)[O-])NCC

InChI

InChI=1S/C20H24N6O2/c1-3-9-22-15-7-5-14(6-8-15)12-23-20-16-10-19(26(27)28)18(21-4-2)11-17(16)24-13-25-20/h5-8,10-11,13,21-22H,3-4,9,12H2,1-2H3,(H,23,24,25)