ethyl 2-oxidanylidene-6-[2-(2-oxidanylideneazepan-1-yl)ethanoyloxymethyl]-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-oxidanylidene-6-[2-(2-oxidanylideneazepan-1-yl)ethanoyloxymethyl]-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-oxo-6-[[2-(2-oxoazepan-1-yl)acetyl]oxymethyl]-4-(2-thienyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 2-oxo-6-[[1-oxo-2-(2-oxo-1-azepanyl)ethoxy]methyl]-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-oxo-6-[[2-(2-oxoazepan-1-yl)acetyl]oxymethyl]-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-6-[[2-(2-ketoazepan-1-yl)acetyl]oxymethyl]-4-(2-thienyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H25N3O6S MolecularWeight: 435.494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CS2)COC(=O)CN3CCCCCC3=O

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CS2)COC(=O)CN3CCCCCC3=O

InChI

InChI=1S/C20H25N3O6S/c1-2-28-19(26)17-13(21-20(27)22-18(17)14-7-6-10-30-14)12-29-16(25)11-23-9-5-3-4-8-15(23)24/h6-7,10,18H,2-5,8-9,11-12H2,1H3,(H2,21,22,27)