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

Systemtic Name: actinium; [4-[4-tert-butyl-6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]sulfanylphenyl]azanide Openeye Name: actinium; [4-[4-tert-butyl-6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]sulfanylphenyl]azanide CAS Name: actinium; [4-[[4-tert-butyl-6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-2-pyrimidinyl]thio]phenyl]azanide IUPAC Name: actinium; [4-[4-tert-butyl-6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]sulfanylphenyl]azanide Traditional Name: actinium; [4-[[4-tert-butyl-6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]thio]phenyl]azanide Formula: C20H23AcN6S- MolecularWeight: 606.529567

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N6S.Ac/c1-20(2,3)16-11-17(23-18-10-15(25-26-18)12-4-5-12)24-19(22-16)27-14-8-6-13(21)7-9-14;/h6-12,21H,4-5H2,1-3H3,(H2,22,23,24,25,26);/q-1;