actinium; [4-[4-(3-methylphenyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxyphenyl]azanide

Systemtic Name: actinium; [4-[4-(3-methylphenyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxyphenyl]azanide Openeye Name: actinium; [4-[4-[(5-methyl-1H-pyrazol-3-yl)amino]-6-(m-tolyl)pyrimidin-2-yl]oxyphenyl]azanide CAS Name: actinium; [4-[[4-(3-methylphenyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-pyrimidinyl]oxy]phenyl]azanide IUPAC Name: actinium; [4-[4-(3-methylphenyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]oxyphenyl]azanide Traditional Name: actinium; [4-[4-[(5-methyl-1H-pyrazol-3-yl)amino]-6-(m-tolyl)pyrimidin-2-yl]oxyphenyl]azanide Formula: C21H19AcN6O- MolecularWeight: 598.442907

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CC(=NC(=N2)OC3=CC=C(C=C3)[NH-])NC4=NNC(=C4)C.[Ac]

Isomeric SMILES

CC1=CC=CC(=C1)C2=CC(=NC(=N2)OC3=CC=C(C=C3)[NH-])NC4=NNC(=C4)C.[Ac]

InChI

InChI=1S/C21H19N6O.Ac/c1-13-4-3-5-15(10-13)18-12-19(24-20-11-14(2)26-27-20)25-21(23-18)28-17-8-6-16(22)7-9-17;/h3-12,22H,1-2H3,(H2,23,24,25,26,27);/q-1;