ethyl 6-[(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)carbonyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)carbonyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[2-chloro-5-(1-piperidylsulfonyl)benzoyl]oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[[2-chloro-5-(1-piperidinylsulfonyl)phenyl]-oxomethoxy]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(2-chloro-5-piperidin-1-ylsulfonylbenzoyl)oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(2-chloro-5-piperidinosulfonyl-benzoyl)oxymethyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H24ClN3O7S MolecularWeight: 485.93846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

InChI

InChI=1S/C20H24ClN3O7S/c1-2-30-19(26)15-11-22-20(27)23-17(15)12-31-18(25)14-10-13(6-7-16(14)21)32(28,29)24-8-4-3-5-9-24/h6-7,10H,2-5,8-9,11-12H2,1H3,(H2,22,23,27)