azanyl-[5-ethoxycarbonyl-4-(4-fluorophenyl)-6-propan-2-yl-pyrimidin-2-yl]-methyl-methylsulfonyl-azanium

Systemtic Name: azanyl-[5-ethoxycarbonyl-4-(4-fluorophenyl)-6-propan-2-yl-pyrimidin-2-yl]-methyl-methylsulfonyl-azanium Openeye Name: amino-[5-ethoxycarbonyl-4-(4-fluorophenyl)-6-isopropyl-pyrimidin-2-yl]-methyl-methylsulfonyl-ammonium CAS Name: amino-[5-ethoxycarbonyl-4-(4-fluorophenyl)-6-propan-2-yl-2-pyrimidinyl]-methyl-methylsulfonylammonium IUPAC Name: amino-[5-ethoxycarbonyl-4-(4-fluorophenyl)-6-propan-2-ylpyrimidin-2-yl]-methyl-methylsulfonylazanium Traditional Name: amino-[5-carbethoxy-4-(4-fluorophenyl)-6-isopropyl-pyrimidin-2-yl]-mesyl-methyl-ammonium Formula: C18H24FN4O4S+ MolecularWeight: 411.470963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=C1C(C)C)[N+](C)(N)S(=O)(=O)C)C2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1C(C)C)[N+](C)(N)S(=O)(=O)C)C2=CC=C(C=C2)F

InChI

InChI=1S/C18H24FN4O4S/c1-6-27-17(24)14-15(11(2)3)21-18(23(4,20)28(5,25)26)22-16(14)12-7-9-13(19)10-8-12/h7-11H,6,20H2,1-5H3/q+1