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

Systemtic Name: cyclobutyl 5-cyano-2-methyl-6-[3-[(phenylmethyl)sulfonylcarbamoyl]azetidin-1-yl]pyridine-3-carboxylate Openeye Name: cyclobutyl 6-[3-(benzylsulfonylcarbamoyl)azetidin-1-yl]-5-cyano-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-6-[3-[oxo-[(phenylmethyl)sulfonylamino]methyl]-1-azetidinyl]-3-pyridinecarboxylic acid cyclobutyl ester IUPAC Name: cyclobutyl 6-[3-(benzylsulfonylcarbamoyl)azetidin-1-yl]-5-cyano-2-methylpyridine-3-carboxylate Traditional Name: 6-[3-(benzylsulfonylcarbamoyl)azetidin-1-yl]-5-cyano-2-methyl-nicotinic acid cyclobutyl ester Formula: C23H24N4O5S MolecularWeight: 468.52546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)N2CC(C2)C(=O)NS(=O)(=O)CC3=CC=CC=C3)C#N)C(=O)OC4CCC4

Isomeric SMILES

CC1=C(C=C(C(=N1)N2CC(C2)C(=O)NS(=O)(=O)CC3=CC=CC=C3)C#N)C(=O)OC4CCC4

InChI

InChI=1S/C23H24N4O5S/c1-15-20(23(29)32-19-8-5-9-19)10-17(11-24)21(25-15)27-12-18(13-27)22(28)26-33(30,31)14-16-6-3-2-4-7-16/h2-4,6-7,10,18-19H,5,8-9,12-14H2,1H3,(H,26,28)