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

Systemtic Name: N4-tert-butyl-N6-(5-chloranyl-2-methoxy-phenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-tert-butyl-N6-(5-chloro-2-methoxy-phenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-tert-butyl-N6-(5-chloro-2-methoxyphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-tert-butyl-6-N-(5-chloro-2-methoxyphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: tert-butyl-[6-(5-chloro-2-methoxy-anilino)-5-nitro-pyrimidin-4-yl]amine Formula: C15H18ClN5O3 MolecularWeight: 351.78812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CC(C)(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C15H18ClN5O3/c1-15(2,3)20-14-12(21(22)23)13(17-8-18-14)19-10-7-9(16)5-6-11(10)24-4/h5-8H,1-4H3,(H2,17,18,19,20)