5-nitro-N4-(4-propan-2-ylphenyl)-N6-prop-2-enyl-pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4-(4-propan-2-ylphenyl)-N6-prop-2-enyl-pyrimidine-4,6-diamine Openeye Name: N6-allyl-N4-(4-isopropylphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-(4-propan-2-ylphenyl)-N6-prop-2-enylpyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N-(4-propan-2-ylphenyl)-6-N-prop-2-enylpyrimidine-4,6-diamine Traditional Name: allyl-(6-cumidino-5-nitro-pyrimidin-4-yl)amine Formula: C16H19N5O2 MolecularWeight: 313.35436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2=C(C(=NC=N2)NCC=C)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC2=C(C(=NC=N2)NCC=C)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O2/c1-4-9-17-15-14(21(22)23)16(19-10-18-15)20-13-7-5-12(6-8-13)11(2)3/h4-8,10-11H,1,9H2,2-3H3,(H2,17,18,19,20)