ethyl 2-(acetyloxymethyl)-5-cyano-6-[3-[(phenylmethyl)sulfonylcarbamoyl]azetidin-1-yl]pyridine-3-carboxylate

Systemtic Name: ethyl 2-(acetyloxymethyl)-5-cyano-6-[3-[(phenylmethyl)sulfonylcarbamoyl]azetidin-1-yl]pyridine-3-carboxylate Openeye Name: ethyl 2-(acetoxymethyl)-6-[3-(benzylsulfonylcarbamoyl)azetidin-1-yl]-5-cyano-pyridine-3-carboxylate CAS Name: 2-(acetyloxymethyl)-5-cyano-6-[3-[oxo-[(phenylmethyl)sulfonylamino]methyl]-1-azetidinyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(acetyloxymethyl)-6-[3-(benzylsulfonylcarbamoyl)azetidin-1-yl]-5-cyanopyridine-3-carboxylate Traditional Name: 2-(acetoxymethyl)-6-[3-(benzylsulfonylcarbamoyl)azetidin-1-yl]-5-cyano-nicotinic acid ethyl ester Formula: C23H24N4O7S MolecularWeight: 500.52426

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)N2CC(C2)C(=O)NS(=O)(=O)CC3=CC=CC=C3)COC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)N2CC(C2)C(=O)NS(=O)(=O)CC3=CC=CC=C3)COC(=O)C

InChI

InChI=1S/C23H24N4O7S/c1-3-33-23(30)19-9-17(10-24)21(25-20(19)13-34-15(2)28)27-11-18(12-27)22(29)26-35(31,32)14-16-7-5-4-6-8-16/h4-9,18H,3,11-14H2,1-2H3,(H,26,29)