N7-ethyl-6-nitro-N4-phenethyl-quinazoline-4,7-diamine

Systemtic Name: N7-ethyl-6-nitro-N4-phenethyl-quinazoline-4,7-diamine Openeye Name: N7-ethyl-6-nitro-N4-phenethyl-quinazoline-4,7-diamine CAS Name: N7-ethyl-6-nitro-N4-phenethylquinazoline-4,7-diamine IUPAC Name: 7-N-ethyl-6-nitro-4-N-phenethylquinazoline-4,7-diamine Traditional Name: ethyl-[6-nitro-4-(phenethylamino)quinazolin-7-yl]amine Formula: C18H19N5O2 MolecularWeight: 337.37576

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C2C(=C1)N=CN=C2NCCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C2C(=C1)N=CN=C2NCCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O2/c1-2-19-16-11-15-14(10-17(16)23(24)25)18(22-12-21-15)20-9-8-13-6-4-3-5-7-13/h3-7,10-12,19H,2,8-9H2,1H3,(H,20,21,22)