ethyl 6-[4-[(4-chlorophenyl)sulfonylamino]phenyl]-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[4-[(4-chlorophenyl)sulfonylamino]phenyl]-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-[4-[(4-chlorophenyl)sulfonylamino]phenyl]-3,4-dimethyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[4-[(4-chlorophenyl)sulfonylamino]phenyl]-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-[(4-chlorophenyl)sulfonylamino]phenyl]-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[4-[(4-chlorophenyl)sulfonylamino]phenyl]-3,4-dimethyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C21H22ClN3O4S2 MolecularWeight: 480.00008

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)NC1C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)NC1C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl)C)C

InChI

InChI=1S/C21H22ClN3O4S2/c1-4-29-20(26)18-13(2)25(3)21(30)23-19(18)14-5-9-16(10-6-14)24-31(27,28)17-11-7-15(22)8-12-17/h5-12,19,24H,4H2,1-3H3,(H,23,30)