5-nitro-N6-prop-2-enyl-N4-(pyridin-3-ylmethyl)pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N6-prop-2-enyl-N4-(pyridin-3-ylmethyl)pyrimidine-4,6-diamine Openeye Name: N6-allyl-5-nitro-N4-(3-pyridylmethyl)pyrimidine-4,6-diamine CAS Name: 5-nitro-N6-prop-2-enyl-N4-(3-pyridinylmethyl)pyrimidine-4,6-diamine IUPAC Name: 5-nitro-6-N-prop-2-enyl-4-N-(pyridin-3-ylmethyl)pyrimidine-4,6-diamine Traditional Name: allyl-[5-nitro-6-(3-pyridylmethylamino)pyrimidin-4-yl]amine Formula: C13H14N6O2 MolecularWeight: 286.28926

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NC=NC(=C1[N+](=O)[O-])NCC2=CN=CC=C2

Isomeric SMILES

C=CCNC1=NC=NC(=C1[N+](=O)[O-])NCC2=CN=CC=C2

InChI

InChI=1S/C13H14N6O2/c1-2-5-15-12-11(19(20)21)13(18-9-17-12)16-8-10-4-3-6-14-7-10/h2-4,6-7,9H,1,5,8H2,(H2,15,16,17,18)