N6-(5-chloranyl-2-methoxy-phenyl)-N4-ethyl-5-nitro-N4-phenyl-pyrimidine-4,6-diamine

Systemtic Name: N6-(5-chloranyl-2-methoxy-phenyl)-N4-ethyl-5-nitro-N4-phenyl-pyrimidine-4,6-diamine Openeye Name: N6-(5-chloro-2-methoxy-phenyl)-N4-ethyl-5-nitro-N4-phenyl-pyrimidine-4,6-diamine CAS Name: N6-(5-chloro-2-methoxyphenyl)-N4-ethyl-5-nitro-N4-phenylpyrimidine-4,6-diamine IUPAC Name: 6-N-(5-chloro-2-methoxyphenyl)-4-N-ethyl-5-nitro-4-N-phenylpyrimidine-4,6-diamine Traditional Name: [6-(5-chloro-2-methoxy-anilino)-5-nitro-pyrimidin-4-yl]-ethyl-phenyl-amine Formula: C19H18ClN5O3 MolecularWeight: 399.83092

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CCN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C19H18ClN5O3/c1-3-24(14-7-5-4-6-8-14)19-17(25(26)27)18(21-12-22-19)23-15-11-13(20)9-10-16(15)28-2/h4-12H,3H2,1-2H3,(H,21,22,23)