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

Systemtic Name: N7-ethyl-N4-[(4-fluorophenyl)methyl]-6-nitro-quinazoline-4,7-diamine Openeye Name: N7-ethyl-N4-[(4-fluorophenyl)methyl]-6-nitro-quinazoline-4,7-diamine CAS Name: N7-ethyl-N4-[(4-fluorophenyl)methyl]-6-nitroquinazoline-4,7-diamine IUPAC Name: 7-N-ethyl-4-N-[(4-fluorophenyl)methyl]-6-nitroquinazoline-4,7-diamine Traditional Name: ethyl-[4-[(4-fluorobenzyl)amino]-6-nitro-quinazolin-7-yl]amine Formula: C17H16FN5O2 MolecularWeight: 341.339643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16FN5O2/c1-2-19-15-8-14-13(7-16(15)23(24)25)17(22-10-21-14)20-9-11-3-5-12(18)6-4-11/h3-8,10,19H,2,9H2,1H3,(H,20,21,22)