N4-cyclopropyl-5-nitro-N2-[3-(pyridin-2-ylmethoxy)phenyl]pyrimidine-2,4-diamine

Systemtic Name: N4-cyclopropyl-5-nitro-N2-[3-(pyridin-2-ylmethoxy)phenyl]pyrimidine-2,4-diamine Openeye Name: N4-cyclopropyl-5-nitro-N2-[3-(2-pyridylmethoxy)phenyl]pyrimidine-2,4-diamine CAS Name: N4-cyclopropyl-5-nitro-N2-[3-(2-pyridinylmethoxy)phenyl]pyrimidine-2,4-diamine IUPAC Name: 4-N-cyclopropyl-5-nitro-2-N-[3-(pyridin-2-ylmethoxy)phenyl]pyrimidine-2,4-diamine Traditional Name: cyclopropyl-[5-nitro-2-[3-(2-pyridylmethoxy)anilino]pyrimidin-4-yl]amine Formula: C19H18N6O3 MolecularWeight: 378.38462

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC(=NC=C2[N+](=O)[O-])NC3=CC(=CC=C3)OCC4=CC=CC=N4

Isomeric SMILES

C1CC1NC2=NC(=NC=C2[N+](=O)[O-])NC3=CC(=CC=C3)OCC4=CC=CC=N4

InChI

InChI=1S/C19H18N6O3/c26-25(27)17-11-21-19(24-18(17)22-13-7-8-13)23-14-5-3-6-16(10-14)28-12-15-4-1-2-9-20-15/h1-6,9-11,13H,7-8,12H2,(H2,21,22,23,24)