(4-propan-2-ylphenyl) 5-chloranyl-2-ethylsulfonyl-pyrimidine-4-carboxylate

Systemtic Name: (4-propan-2-ylphenyl) 5-chloranyl-2-ethylsulfonyl-pyrimidine-4-carboxylate Openeye Name: (4-isopropylphenyl) 5-chloro-2-ethylsulfonyl-pyrimidine-4-carboxylate CAS Name: 5-chloro-2-ethylsulfonyl-4-pyrimidinecarboxylic acid (4-propan-2-ylphenyl) ester IUPAC Name: (4-propan-2-ylphenyl) 5-chloro-2-ethylsulfonylpyrimidine-4-carboxylate Traditional Name: 5-chloro-2-esyl-pyrimidine-4-carboxylic acid p-cumenyl ester Formula: C16H17ClN2O4S MolecularWeight: 368.83518

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)OC2=CC=C(C=C2)C(C)C)Cl

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)OC2=CC=C(C=C2)C(C)C)Cl

InChI

InChI=1S/C16H17ClN2O4S/c1-4-24(21,22)16-18-9-13(17)14(19-16)15(20)23-12-7-5-11(6-8-12)10(2)3/h5-10H,4H2,1-3H3