3-tert-butyl-1-[(6-chloranylpyridin-3-yl)methyl]-N-methyl-5-nitro-2,4-dihydropyrimidin-6-amine

Systemtic Name: 3-tert-butyl-1-[(6-chloranylpyridin-3-yl)methyl]-N-methyl-5-nitro-2,4-dihydropyrimidin-6-amine Openeye Name: 3-tert-butyl-1-[(6-chloro-3-pyridyl)methyl]-N-methyl-5-nitro-2,4-dihydropyrimidin-6-amine CAS Name: 3-tert-butyl-1-[(6-chloro-3-pyridinyl)methyl]-N-methyl-5-nitro-2,4-dihydropyrimidin-6-amine IUPAC Name: 3-tert-butyl-1-[(6-chloropyridin-3-yl)methyl]-N-methyl-5-nitro-2,4-dihydropyrimidin-6-amine Traditional Name: [3-tert-butyl-1-[(6-chloro-3-pyridyl)methyl]-5-nitro-2,4-dihydropyrimidin-6-yl]-methyl-amine Formula: C15H22ClN5O2 MolecularWeight: 339.82048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CC(=C(N(C1)CC2=CN=C(C=C2)Cl)NC)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)N1CC(=C(N(C1)CC2=CN=C(C=C2)Cl)NC)[N+](=O)[O-]

InChI

InChI=1S/C15H22ClN5O2/c1-15(2,3)20-9-12(21(22)23)14(17-4)19(10-20)8-11-5-6-13(16)18-7-11/h5-7,17H,8-10H2,1-4H3