N-[(2-chloranyl-6-methyl-phenyl)methyl]-6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-[(2-chloranyl-6-methyl-phenyl)methyl]-6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-amine Openeye Name: N-[(2-chloro-6-methyl-phenyl)methyl]-6-(2,6-dimethylmorpholin-4-yl)-5-nitro-pyrimidin-4-amine CAS Name: N-[(2-chloro-6-methylphenyl)methyl]-6-(2,6-dimethyl-4-morpholinyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-[(2-chloro-6-methylphenyl)methyl]-6-(2,6-dimethylmorpholin-4-yl)-5-nitropyrimidin-4-amine Traditional Name: (2-chloro-6-methyl-benzyl)-[6-(2,6-dimethylmorpholino)-5-nitro-pyrimidin-4-yl]amine Formula: C18H22ClN5O3 MolecularWeight: 391.85198

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C2=C(C(=NC=N2)NCC3=C(C=CC=C3Cl)C)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CC(O1)C)C2=C(C(=NC=N2)NCC3=C(C=CC=C3Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C18H22ClN5O3/c1-11-5-4-6-15(19)14(11)7-20-17-16(24(25)26)18(22-10-21-17)23-8-12(2)27-13(3)9-23/h4-6,10,12-13H,7-9H2,1-3H3,(H,20,21,22)