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

Systemtic Name: N4-(4-ethoxyphenyl)-5-nitro-N2-phenyl-pyrimidine-2,4,6-triamine Openeye Name: N4-(4-ethoxyphenyl)-5-nitro-N2-phenyl-pyrimidine-2,4,6-triamine CAS Name: N4-(4-ethoxyphenyl)-5-nitro-N2-phenylpyrimidine-2,4,6-triamine IUPAC Name: 4-N-(4-ethoxyphenyl)-5-nitro-2-N-phenylpyrimidine-2,4,6-triamine Traditional Name: (6-amino-2-anilino-5-nitro-pyrimidin-4-yl)-p-phenetyl-amine Formula: C18H18N6O3 MolecularWeight: 366.37392

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)NC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC(=NC(=C2[N+](=O)[O-])N)NC3=CC=CC=C3

InChI

InChI=1S/C18H18N6O3/c1-2-27-14-10-8-13(9-11-14)20-17-15(24(25)26)16(19)22-18(23-17)21-12-6-4-3-5-7-12/h3-11H,2H2,1H3,(H4,19,20,21,22,23)