6-nitro-N4-prop-2-enyl-N2-(pyridin-2-ylmethyl)quinazoline-2,4-diamine

Systemtic Name: 6-nitro-N4-prop-2-enyl-N2-(pyridin-2-ylmethyl)quinazoline-2,4-diamine Openeye Name: N4-allyl-6-nitro-N2-(2-pyridylmethyl)quinazoline-2,4-diamine CAS Name: 6-nitro-N4-prop-2-enyl-N2-(2-pyridinylmethyl)quinazoline-2,4-diamine IUPAC Name: 6-nitro-4-N-prop-2-enyl-2-N-(pyridin-2-ylmethyl)quinazoline-2,4-diamine Traditional Name: allyl-[6-nitro-2-(2-pyridylmethylamino)quinazolin-4-yl]amine Formula: C17H16N6O2 MolecularWeight: 336.34794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NC(=NC2=C1C=C(C=C2)[N+](=O)[O-])NCC3=CC=CC=N3

Isomeric SMILES

C=CCNC1=NC(=NC2=C1C=C(C=C2)[N+](=O)[O-])NCC3=CC=CC=N3

InChI

InChI=1S/C17H16N6O2/c1-2-8-19-16-14-10-13(23(24)25)6-7-15(14)21-17(22-16)20-11-12-5-3-4-9-18-12/h2-7,9-10H,1,8,11H2,(H2,19,20,21,22)