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

Systemtic Name: 2-methylpropyl 6-[3-[(4-fluorophenyl)sulfonylamino]phenyl]-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isobutyl 6-[3-[(4-fluorophenyl)sulfonylamino]phenyl]-3,4-dimethyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[3-[(4-fluorophenyl)sulfonylamino]phenyl]-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 6-[3-[(4-fluorophenyl)sulfonylamino]phenyl]-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[3-[(4-fluorophenyl)sulfonylamino]phenyl]-3,4-dimethyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid isobutyl ester Formula: C23H26FN3O4S2 MolecularWeight: 491.598643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)F)C(=O)OCC(C)C

Isomeric SMILES

CC1=C(C(NC(=S)N1C)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)F)C(=O)OCC(C)C

InChI

InChI=1S/C23H26FN3O4S2/c1-14(2)13-31-22(28)20-15(3)27(4)23(32)25-21(20)16-6-5-7-18(12-16)26-33(29,30)19-10-8-17(24)9-11-19/h5-12,14,21,26H,13H2,1-4H3,(H,25,32)