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

Systemtic Name: 2-[[4,6-bis(4-oxidanylpiperidin-1-yl)pyrimidin-2-yl]amino]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[[4,6-bis(4-hydroxy-1-piperidyl)pyrimidin-2-yl]amino]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[[4,6-bis(4-hydroxy-1-piperidinyl)-2-pyrimidinyl]amino]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[[4,6-bis(4-hydroxypiperidin-1-yl)pyrimidin-2-yl]amino]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[[4,6-bis(4-hydroxypiperidino)pyrimidin-2-yl]amino]-4-methyl-thiazole-5-carboxylic acid Formula: C19H26N6O4S MolecularWeight: 434.51254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N6O4S/c1-11-16(17(28)29)30-19(20-11)23-18-21-14(24-6-2-12(26)3-7-24)10-15(22-18)25-8-4-13(27)5-9-25/h10,12-13,26-27H,2-9H2,1H3,(H,28,29)(H,20,21,22,23)