N7-ethyl-6-nitro-N4-(pyridin-4-ylmethyl)quinazoline-4,7-diamine

Systemtic Name: N7-ethyl-6-nitro-N4-(pyridin-4-ylmethyl)quinazoline-4,7-diamine Openeye Name: N7-ethyl-6-nitro-N4-(4-pyridylmethyl)quinazoline-4,7-diamine CAS Name: N7-ethyl-6-nitro-N4-(pyridin-4-ylmethyl)quinazoline-4,7-diamine IUPAC Name: 7-N-ethyl-6-nitro-4-N-(pyridin-4-ylmethyl)quinazoline-4,7-diamine Traditional Name: ethyl-[6-nitro-4-(4-pyridylmethylamino)quinazolin-7-yl]amine Formula: C16H16N6O2 MolecularWeight: 324.33724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N6O2/c1-2-18-14-8-13-12(7-15(14)22(23)24)16(21-10-20-13)19-9-11-3-5-17-6-4-11/h3-8,10,18H,2,9H2,1H3,(H,19,20,21)