ethyl 2-oxidanylidene-4-phenyl-6-[3-(thiophen-2-ylsulfonylamino)propanoyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-oxidanylidene-4-phenyl-6-[3-(thiophen-2-ylsulfonylamino)propanoyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-oxo-4-phenyl-6-[3-(2-thienylsulfonylamino)propanoyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 2-oxo-6-[[1-oxo-3-(thiophen-2-ylsulfonylamino)propoxy]methyl]-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-oxo-4-phenyl-6-[3-(thiophen-2-ylsulfonylamino)propanoyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-4-phenyl-6-[3-(2-thienylsulfonylamino)propanoyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H23N3O7S2 MolecularWeight: 493.55322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)COC(=O)CCNS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)COC(=O)CCNS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H23N3O7S2/c1-2-30-20(26)18-15(23-21(27)24-19(18)14-7-4-3-5-8-14)13-31-16(25)10-11-22-33(28,29)17-9-6-12-32-17/h3-9,12,19,22H,2,10-11,13H2,1H3,(H2,23,24,27)