[(2S)-1-[5-bromanyl-2-(6-phenylpyrimidin-4-yl)oxy-phenyl]propan-2-yl]azanium

Systemtic Name: [(2S)-1-[5-bromanyl-2-(6-phenylpyrimidin-4-yl)oxy-phenyl]propan-2-yl]azanium Openeye Name: [(1S)-2-[5-bromo-2-(6-phenylpyrimidin-4-yl)oxy-phenyl]-1-methyl-ethyl]ammonium CAS Name: [(2S)-1-[5-bromo-2-[(6-phenyl-4-pyrimidinyl)oxy]phenyl]propan-2-yl]ammonium IUPAC Name: [(2S)-1-[5-bromo-2-(6-phenylpyrimidin-4-yl)oxyphenyl]propan-2-yl]azanium Traditional Name: [(1S)-2-[5-bromo-2-(6-phenylpyrimidin-4-yl)oxy-phenyl]-1-methyl-ethyl]ammonium Formula: C19H19BrN3O+ MolecularWeight: 385.27766

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C(C=CC(=C1)Br)OC2=NC=NC(=C2)C3=CC=CC=C3)[NH3+]

Isomeric SMILES

C[C@@H](CC1=C(C=CC(=C1)Br)OC2=NC=NC(=C2)C3=CC=CC=C3)[NH3+]

InChI

InChI=1S/C19H18BrN3O/c1-13(21)9-15-10-16(20)7-8-18(15)24-19-11-17(22-12-23-19)14-5-3-2-4-6-14/h2-8,10-13H,9,21H2,1H3/p+1/t13-/m0/s1