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6-nitro-N4-(phenylmethyl)-N7-propyl-quinazoline-4,7-diamine

6-nitro-N4-(phenylmethyl)-N7-propyl-quinazoline-4,7-diamine

Systemtic Name:6-nitro-N4-(phenylmethyl)-N7-propyl-quinazoline-4,7-diamine
Openeye Name:N4-benzyl-6-nitro-N7-propyl-quinazoline-4,7-diamine
CAS Name:6-nitro-N4-(phenylmethyl)-N7-propylquinazoline-4,7-diamine
IUPAC Name:4-N-benzyl-6-nitro-7-N-propylquinazoline-4,7-diamine
Traditional Name:benzyl-[6-nitro-7-(propylamino)quinazolin-4-yl]amine
Formula: C18H19N5O2
MolecularWeight: 337.37576
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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C2C(=C1)N=CN=C2NCC3=CC=CC=C3)[N+](=O)[O-]


Isomeric SMILES

CCCNC1=C(C=C2C(=C1)N=CN=C2NCC3=CC=CC=C3)[N+](=O)[O-]


InChI

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


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