actinium; 2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)-6-piperidin-1-id-2-yl-pyrimidin-4-amine

Systemtic Name: actinium; 2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)-6-piperidin-1-id-2-yl-pyrimidin-4-amine Openeye Name: actinium; 2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)-6-piperidin-1-id-2-yl-pyrimidin-4-amine CAS Name: actinium; 2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)-6-(2-piperidin-1-idyl)-4-pyrimidinamine IUPAC Name: actinium; 2-(2-chlorophenyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)-6-piperidin-1-id-2-ylpyrimidin-4-amine Traditional Name: actinium; [2-(2-chlorophenyl)-6-piperidin-1-id-2-yl-pyrimidin-4-yl]-(5-methyl-1H-1,2,4-triazol-3-yl)amine Formula: C18H19AcClN7- MolecularWeight: 595.871107

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)NC2=NC(=NC(=C2)C3CCCC[N-]3)C4=CC=CC=C4Cl.[Ac]

Isomeric SMILES

CC1=NC(=NN1)NC2=NC(=NC(=C2)C3CCCC[N-]3)C4=CC=CC=C4Cl.[Ac]

InChI

InChI=1S/C18H19ClN7.Ac/c1-11-21-18(26-25-11)24-16-10-15(14-8-4-5-9-20-14)22-17(23-16)12-6-2-3-7-13(12)19;/h2-3,6-7,10,14H,4-5,8-9H2,1H3,(H2,21,22,23,24,25,26);/q-1;