5-nitro-N4-phenyl-2-pyrrolidin-1-yl-pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4-phenyl-2-pyrrolidin-1-yl-pyrimidine-4,6-diamine Openeye Name: 5-nitro-N4-phenyl-2-pyrrolidin-1-yl-pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-phenyl-2-(1-pyrrolidinyl)pyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N-phenyl-2-pyrrolidin-1-ylpyrimidine-4,6-diamine Traditional Name: (6-amino-5-nitro-2-pyrrolidino-pyrimidin-4-yl)-phenyl-amine Formula: C14H16N6O2 MolecularWeight: 300.31584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=C(C(=N2)NC3=CC=CC=C3)[N+](=O)[O-])N

Isomeric SMILES

C1CCN(C1)C2=NC(=C(C(=N2)NC3=CC=CC=C3)[N+](=O)[O-])N

InChI

InChI=1S/C14H16N6O2/c15-12-11(20(21)22)13(16-10-6-2-1-3-7-10)18-14(17-12)19-8-4-5-9-19/h1-3,6-7H,4-5,8-9H2,(H3,15,16,17,18)