2-methylpropyl 2-[(5-chloranyl-2-methylsulfonyl-pyrimidin-4-yl)carbonylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: 2-methylpropyl 2-[(5-chloranyl-2-methylsulfonyl-pyrimidin-4-yl)carbonylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: isobutyl 2-[(5-chloro-2-methylsulfonyl-pyrimidine-4-carbonyl)amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[(5-chloro-2-methylsulfonyl-4-pyrimidinyl)-oxomethyl]amino]-4-methyl-5-thiazolecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[(5-chloro-2-methylsulfonylpyrimidine-4-carbonyl)amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(5-chloro-2-mesyl-pyrimidine-4-carbonyl)amino]-4-methyl-thiazole-5-carboxylic acid isobutyl ester Formula: C15H17ClN4O5S2 MolecularWeight: 432.90228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=NC(=NC=C2Cl)S(=O)(=O)C)C(=O)OCC(C)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=NC(=NC=C2Cl)S(=O)(=O)C)C(=O)OCC(C)C

InChI

InChI=1S/C15H17ClN4O5S2/c1-7(2)6-25-13(22)11-8(3)18-14(26-11)20-12(21)10-9(16)5-17-15(19-10)27(4,23)24/h5,7H,6H2,1-4H3,(H,18,20,21)