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

Systemtic Name: ethyl 4-[3-[(4-methoxyphenyl)sulfonylamino]phenoxy]-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[3-[(4-methoxyphenyl)sulfonylamino]phenoxy]-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-[3-[(4-methoxyphenyl)sulfonylamino]phenoxy]-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[(4-methoxyphenyl)sulfonylamino]phenoxy]-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-[3-[(4-methoxyphenyl)sulfonylamino]phenoxy]-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C21H21N3O6S2 MolecularWeight: 475.53794

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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)OC)SC

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O6S2/c1-4-29-20(25)18-13-22-21(31-3)23-19(18)30-16-7-5-6-14(12-16)24-32(26,27)17-10-8-15(28-2)9-11-17/h5-13,24H,4H2,1-3H3