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

Systemtic Name: methyl 3-ethyl-4-methyl-6-[4-(phenylsulfonylamino)phenyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 6-[4-(benzenesulfonamido)phenyl]-3-ethyl-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[4-(benzenesulfonamido)phenyl]-3-ethyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 6-[4-(benzenesulfonamido)phenyl]-3-ethyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[4-(benzenesulfonamido)phenyl]-3-ethyl-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C21H23N3O4S2 MolecularWeight: 445.55502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O4S2/c1-4-24-14(2)18(20(25)28-3)19(22-21(24)29)15-10-12-16(13-11-15)23-30(26,27)17-8-6-5-7-9-17/h5-13,19,23H,4H2,1-3H3,(H,22,29)