(4-cyanophenyl) 5-chloranyl-2-propylsulfonyl-pyrimidine-4-carboxylate

Systemtic Name: (4-cyanophenyl) 5-chloranyl-2-propylsulfonyl-pyrimidine-4-carboxylate Openeye Name: (4-cyanophenyl) 5-chloro-2-propylsulfonyl-pyrimidine-4-carboxylate CAS Name: 5-chloro-2-propylsulfonyl-4-pyrimidinecarboxylic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 5-chloro-2-propylsulfonylpyrimidine-4-carboxylate Traditional Name: 5-chloro-2-propylsulfonyl-pyrimidine-4-carboxylic acid (4-cyanophenyl) ester Formula: C15H12ClN3O4S MolecularWeight: 365.79148

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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#N)Cl

Isomeric SMILES

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

InChI

InChI=1S/C15H12ClN3O4S/c1-2-7-24(21,22)15-18-9-12(16)13(19-15)14(20)23-11-5-3-10(8-17)4-6-11/h3-6,9H,2,7H2,1H3