ethyl 4-[3-[(4-chlorophenyl)sulfonylamino]phenoxy]-2-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[3-[(4-chlorophenyl)sulfonylamino]phenoxy]-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[3-[(4-chlorophenyl)sulfonylamino]phenoxy]-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-[3-[(4-chlorophenyl)sulfonylamino]phenoxy]-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[(4-chlorophenyl)sulfonylamino]phenoxy]-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-[3-[(4-chlorophenyl)sulfonylamino]phenoxy]-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C20H18ClN3O5S2 MolecularWeight: 479.95702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1OC2=CC=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1OC2=CC=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl)SC

InChI

InChI=1S/C20H18ClN3O5S2/c1-3-28-19(25)17-12-22-20(30-2)23-18(17)29-15-6-4-5-14(11-15)24-31(26,27)16-9-7-13(21)8-10-16/h4-12,24H,3H2,1-2H3