actinium; [1-[[5-(4-fluorophenyl)-1-methyl-6-oxidanylidene-4-pyridin-4-yl-pyrimidin-2-yl]amino]-3-phenyl-propan-2-yl]azanide

Systemtic Name: actinium; [1-[[5-(4-fluorophenyl)-1-methyl-6-oxidanylidene-4-pyridin-4-yl-pyrimidin-2-yl]amino]-3-phenyl-propan-2-yl]azanide Openeye Name: actinium; [1-benzyl-2-[[5-(4-fluorophenyl)-1-methyl-6-oxo-4-(4-pyridyl)pyrimidin-2-yl]amino]ethyl]azanide CAS Name: actinium; [1-[[5-(4-fluorophenyl)-1-methyl-6-oxo-4-pyridin-4-yl-2-pyrimidinyl]amino]-3-phenylpropan-2-yl]azanide IUPAC Name: actinium; [1-[[5-(4-fluorophenyl)-1-methyl-6-oxo-4-pyridin-4-ylpyrimidin-2-yl]amino]-3-phenylpropan-2-yl]azanide Traditional Name: actinium; [1-benzyl-2-[[5-(4-fluorophenyl)-6-keto-1-methyl-4-(4-pyridyl)pyrimidin-2-yl]amino]ethyl]azanide Formula: C25H23AcFN5O- MolecularWeight: 655.50917

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N=C1NCC(CC2=CC=CC=C2)[NH-])C3=CC=NC=C3)C4=CC=C(C=C4)F.[Ac]

Isomeric SMILES

CN1C(=O)C(=C(N=C1NCC(CC2=CC=CC=C2)[NH-])C3=CC=NC=C3)C4=CC=C(C=C4)F.[Ac]

InChI

InChI=1S/C25H23FN5O.Ac/c1-31-24(32)22(18-7-9-20(26)10-8-18)23(19-11-13-28-14-12-19)30-25(31)29-16-21(27)15-17-5-3-2-4-6-17;/h2-14,21,27H,15-16H2,1H3,(H,29,30);/q-1;