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

Systemtic Name: ethyl (4S)-6-[3-[(3,4-dimethylphenyl)sulfonylamino]propanoyloxymethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-6-[3-[(3,4-dimethylphenyl)sulfonylamino]propanoyloxymethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-[[3-[(3,4-dimethylphenyl)sulfonylamino]-1-oxopropoxy]methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-[3-[(3,4-dimethylphenyl)sulfonylamino]propanoyloxymethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-[3-[(3,4-dimethylphenyl)sulfonylamino]propanoyloxymethyl]-2-keto-4-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H27N3O7S MolecularWeight: 453.50928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27N3O7S/c1-5-29-19(25)18-14(4)22-20(26)23-16(18)11-30-17(24)8-9-21-31(27,28)15-7-6-12(2)13(3)10-15/h6-7,10,14,21H,5,8-9,11H2,1-4H3,(H2,22,23,26)/t14-/m0/s1