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

Systemtic Name: ethyl 3-ethyl-4-methyl-2-sulfanylidene-6-[4-[(2,4,6-trimethylphenyl)sulfonylamino]phenyl]-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-ethyl-4-methyl-2-thioxo-6-[4-[(2,4,6-trimethylphenyl)sulfonylamino]phenyl]-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-ethyl-4-methyl-2-sulfanylidene-6-[4-[(2,4,6-trimethylphenyl)sulfonylamino]phenyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-ethyl-4-methyl-2-sulfanylidene-6-[4-[(2,4,6-trimethylphenyl)sulfonylamino]phenyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-ethyl-6-[4-(mesitylsulfonylamino)phenyl]-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C25H31N3O4S2 MolecularWeight: 501.66134

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=S)C2=CC=C(C=C2)NS(=O)(=O)C3=C(C=C(C=C3C)C)C)C(=O)OCC)C

Isomeric SMILES

CCN1C(=C(C(NC1=S)C2=CC=C(C=C2)NS(=O)(=O)C3=C(C=C(C=C3C)C)C)C(=O)OCC)C

InChI

InChI=1S/C25H31N3O4S2/c1-7-28-18(6)21(24(29)32-8-2)22(26-25(28)33)19-9-11-20(12-10-19)27-34(30,31)23-16(4)13-15(3)14-17(23)5/h9-14,22,27H,7-8H2,1-6H3,(H,26,33)