N2-(3-methoxypropyl)-5-nitro-N4-phenyl-pyrimidine-2,4,6-triamine

Systemtic Name: N2-(3-methoxypropyl)-5-nitro-N4-phenyl-pyrimidine-2,4,6-triamine Openeye Name: N2-(3-methoxypropyl)-5-nitro-N4-phenyl-pyrimidine-2,4,6-triamine CAS Name: N2-(3-methoxypropyl)-5-nitro-N4-phenylpyrimidine-2,4,6-triamine IUPAC Name: 2-N-(3-methoxypropyl)-5-nitro-4-N-phenylpyrimidine-2,4,6-triamine Traditional Name: (4-amino-6-anilino-5-nitro-pyrimidin-2-yl)-(3-methoxypropyl)amine Formula: C14H18N6O3 MolecularWeight: 318.33112

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC1=NC(=C(C(=N1)NC2=CC=CC=C2)[N+](=O)[O-])N

Isomeric SMILES

COCCCNC1=NC(=C(C(=N1)NC2=CC=CC=C2)[N+](=O)[O-])N

InChI

InChI=1S/C14H18N6O3/c1-23-9-5-8-16-14-18-12(15)11(20(21)22)13(19-14)17-10-6-3-2-4-7-10/h2-4,6-7H,5,8-9H2,1H3,(H4,15,16,17,18,19)