N4-cyclopropyl-5-nitro-N2-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]pyrimidine-2,4-diamine

Systemtic Name: N4-cyclopropyl-5-nitro-N2-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]pyrimidine-2,4-diamine Openeye Name: N4-cyclopropyl-5-nitro-N2-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]pyrimidine-2,4-diamine CAS Name: N4-cyclopropyl-5-nitro-N2-[[2-(1-pyrrolidinylmethyl)phenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 4-N-cyclopropyl-5-nitro-2-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]pyrimidine-2,4-diamine Traditional Name: cyclopropyl-[5-nitro-2-[[2-(pyrrolidinomethyl)benzyl]amino]pyrimidin-4-yl]amine Formula: C19H24N6O2 MolecularWeight: 368.43286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=CC=C2CNC3=NC=C(C(=N3)NC4CC4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)CC2=CC=CC=C2CNC3=NC=C(C(=N3)NC4CC4)[N+](=O)[O-]

InChI

InChI=1S/C19H24N6O2/c26-25(27)17-12-21-19(23-18(17)22-16-7-8-16)20-11-14-5-1-2-6-15(14)13-24-9-3-4-10-24/h1-2,5-6,12,16H,3-4,7-11,13H2,(H2,20,21,22,23)