ethyl (4S)-4-(4-methoxyphenyl)-2-oxidanylidene-6-(4-thiophen-2-ylbutanoyloxymethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-(4-methoxyphenyl)-2-oxidanylidene-6-(4-thiophen-2-ylbutanoyloxymethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-(4-methoxyphenyl)-2-oxo-6-[4-(2-thienyl)butanoyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(4-methoxyphenyl)-2-oxo-6-[(1-oxo-4-thiophen-2-ylbutoxy)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-(4-methoxyphenyl)-2-oxo-6-(4-thiophen-2-ylbutanoyloxymethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-2-keto-4-(4-methoxyphenyl)-6-[4-(2-thienyl)butanoyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C23H26N2O6S MolecularWeight: 458.52734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)OC)COC(=O)CCCC3=CC=CS3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@H]1C2=CC=C(C=C2)OC)COC(=O)CCCC3=CC=CS3

InChI

InChI=1S/C23H26N2O6S/c1-3-30-22(27)20-18(14-31-19(26)8-4-6-17-7-5-13-32-17)24-23(28)25-21(20)15-9-11-16(29-2)12-10-15/h5,7,9-13,21H,3-4,6,8,14H2,1-2H3,(H2,24,25,28)/t21-/m0/s1