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

Systemtic Name: ethyl (4S)-4-methyl-2-oxidanylidene-6-[3-(thiophen-2-ylsulfonylamino)propanoyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-methyl-2-oxo-6-[3-(2-thienylsulfonylamino)propanoyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-methyl-2-oxo-6-[[1-oxo-3-(thiophen-2-ylsulfonylamino)propoxy]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-methyl-2-oxo-6-[3-(thiophen-2-ylsulfonylamino)propanoyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-2-keto-4-methyl-6-[3-(2-thienylsulfonylamino)propanoyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C16H21N3O7S2 MolecularWeight: 431.48384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)COC(=O)CCNS(=O)(=O)C2=CC=CS2

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@H]1C)COC(=O)CCNS(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C16H21N3O7S2/c1-3-25-15(21)14-10(2)18-16(22)19-11(14)9-26-12(20)6-7-17-28(23,24)13-5-4-8-27-13/h4-5,8,10,17H,3,6-7,9H2,1-2H3,(H2,18,19,22)/t10-/m0/s1