actinium; [4-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6-(propylcarbamoyl)pyrimidin-2-yl]sulfanylphenyl]azanide

Systemtic Name: actinium; [4-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6-(propylcarbamoyl)pyrimidin-2-yl]sulfanylphenyl]azanide Openeye Name: actinium; [4-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6-(propylcarbamoyl)pyrimidin-2-yl]sulfanylphenyl]azanide CAS Name: actinium; [4-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6-[oxo(propylamino)methyl]-2-pyrimidinyl]thio]phenyl]azanide IUPAC Name: actinium; [4-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6-(propylcarbamoyl)pyrimidin-2-yl]sulfanylphenyl]azanide Traditional Name: actinium; [4-[[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6-(propylcarbamoyl)pyrimidin-2-yl]thio]phenyl]azanide Formula: C20H22AcN7OS- MolecularWeight: 635.527727

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC(=NC(=N1)SC2=CC=C(C=C2)[NH-])NC3=NNC(=C3)C4CC4.[Ac]

Isomeric SMILES

CCCNC(=O)C1=CC(=NC(=N1)SC2=CC=C(C=C2)[NH-])NC3=NNC(=C3)C4CC4.[Ac]

InChI

InChI=1S/C20H22N7OS.Ac/c1-2-9-22-19(28)16-11-17(24-18-10-15(26-27-18)12-3-4-12)25-20(23-16)29-14-7-5-13(21)6-8-14;/h5-8,10-12,21H,2-4,9H2,1H3,(H3,22,23,24,25,26,27,28);/q-1;