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

Systemtic Name: N7-ethyl-N4-[(4-methylphenyl)methyl]-6-nitro-quinazoline-4,7-diamine Openeye Name: N7-ethyl-6-nitro-N4-(p-tolylmethyl)quinazoline-4,7-diamine CAS Name: N7-ethyl-N4-[(4-methylphenyl)methyl]-6-nitroquinazoline-4,7-diamine IUPAC Name: 7-N-ethyl-4-N-[(4-methylphenyl)methyl]-6-nitroquinazoline-4,7-diamine Traditional Name: ethyl-[4-[(4-methylbenzyl)amino]-6-nitro-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=C2NCC3=CC=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C2C(=C1)N=CN=C2NCC3=CC=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O2/c1-3-19-16-9-15-14(8-17(16)23(24)25)18(22-11-21-15)20-10-13-6-4-12(2)5-7-13/h4-9,11,19H,3,10H2,1-2H3,(H,20,21,22)