ethyl 2-[[4-chloranyl-6-(4-oxidanylpiperidin-1-yl)pyrimidin-2-yl]amino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[[4-chloranyl-6-(4-oxidanylpiperidin-1-yl)pyrimidin-2-yl]amino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[4-chloro-6-(4-hydroxy-1-piperidyl)pyrimidin-2-yl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[4-chloro-6-(4-hydroxy-1-piperidinyl)-2-pyrimidinyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-chloro-6-(4-hydroxypiperidin-1-yl)pyrimidin-2-yl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[4-chloro-6-(4-hydroxypiperidino)pyrimidin-2-yl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C16H20ClN5O3S MolecularWeight: 397.8797

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC2=NC(=CC(=N2)Cl)N3CCC(CC3)O)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC2=NC(=CC(=N2)Cl)N3CCC(CC3)O)C

InChI

InChI=1S/C16H20ClN5O3S/c1-3-25-14(24)13-9(2)18-16(26-13)21-15-19-11(17)8-12(20-15)22-6-4-10(23)5-7-22/h8,10,23H,3-7H2,1-2H3,(H,18,19,20,21)