4-methyl-2-[[4-(4-methyl-4-oxidanyl-piperidin-1-yl)-6-(4-oxidanylpiperidin-1-yl)pyrimidin-2-yl]amino]-1,3-thiazole-5-carboxylic acid

Systemtic Name: 4-methyl-2-[[4-(4-methyl-4-oxidanyl-piperidin-1-yl)-6-(4-oxidanylpiperidin-1-yl)pyrimidin-2-yl]amino]-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[[4-(4-hydroxy-4-methyl-1-piperidyl)-6-(4-hydroxy-1-piperidyl)pyrimidin-2-yl]amino]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[[4-(4-hydroxy-4-methyl-1-piperidinyl)-6-(4-hydroxy-1-piperidinyl)-2-pyrimidinyl]amino]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[[4-(4-hydroxy-4-methylpiperidin-1-yl)-6-(4-hydroxypiperidin-1-yl)pyrimidin-2-yl]amino]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[[4-(4-hydroxy-4-methyl-piperidino)-6-(4-hydroxypiperidino)pyrimidin-2-yl]amino]-4-methyl-thiazole-5-carboxylic acid Formula: C20H28N6O4S MolecularWeight: 448.53912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC2=NC(=CC(=N2)N3CCC(CC3)(C)O)N4CCC(CC4)O)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)NC2=NC(=CC(=N2)N3CCC(CC3)(C)O)N4CCC(CC4)O)C(=O)O

InChI

InChI=1S/C20H28N6O4S/c1-12-16(17(28)29)31-19(21-12)24-18-22-14(25-7-3-13(27)4-8-25)11-15(23-18)26-9-5-20(2,30)6-10-26/h11,13,27,30H,3-10H2,1-2H3,(H,28,29)(H,21,22,23,24)