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

Systemtic Name: (4-propan-2-ylphenyl) 5-chloranyl-2-propylsulfonyl-pyrimidine-4-carboxylate Openeye Name: (4-isopropylphenyl) 5-chloro-2-propylsulfonyl-pyrimidine-4-carboxylate CAS Name: 5-chloro-2-propylsulfonyl-4-pyrimidinecarboxylic acid (4-propan-2-ylphenyl) ester IUPAC Name: (4-propan-2-ylphenyl) 5-chloro-2-propylsulfonylpyrimidine-4-carboxylate Traditional Name: 5-chloro-2-propylsulfonyl-pyrimidine-4-carboxylic acid p-cumenyl ester Formula: C17H19ClN2O4S MolecularWeight: 382.86176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19ClN2O4S/c1-4-9-25(22,23)17-19-10-14(18)15(20-17)16(21)24-13-7-5-12(6-8-13)11(2)3/h5-8,10-11H,4,9H2,1-3H3