N4-methyl-5-nitro-N6-(oxolan-2-ylmethyl)-N4-phenyl-pyrimidine-4,6-diamine

Systemtic Name: N4-methyl-5-nitro-N6-(oxolan-2-ylmethyl)-N4-phenyl-pyrimidine-4,6-diamine Openeye Name: N4-methyl-5-nitro-N4-phenyl-N6-(tetrahydrofuran-2-ylmethyl)pyrimidine-4,6-diamine CAS Name: N4-methyl-5-nitro-N6-(2-oxolanylmethyl)-N4-phenylpyrimidine-4,6-diamine IUPAC Name: 4-N-methyl-5-nitro-6-N-(oxolan-2-ylmethyl)-4-N-phenylpyrimidine-4,6-diamine Traditional Name: methyl-[5-nitro-6-(tetrahydrofurfurylamino)pyrimidin-4-yl]-phenyl-amine Formula: C16H19N5O3 MolecularWeight: 329.35376

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NCC3CCCO3

Isomeric SMILES

CN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NCC3CCCO3

InChI

InChI=1S/C16H19N5O3/c1-20(12-6-3-2-4-7-12)16-14(21(22)23)15(18-11-19-16)17-10-13-8-5-9-24-13/h2-4,6-7,11,13H,5,8-10H2,1H3,(H,17,18,19)