1-[4-(azepan-1-ylsulfonyl)phenyl]-N-(3-methylpyridin-2-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: 1-[4-(azepan-1-ylsulfonyl)phenyl]-N-(3-methylpyridin-2-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-[4-(azepan-1-ylsulfonyl)phenyl]-N-(3-methyl-2-pyridyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-[4-(1-azepanylsulfonyl)phenyl]-N-(3-methyl-2-pyridinyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: 1-[4-(azepan-1-ylsulfonyl)phenyl]-N-(3-methylpyridin-2-yl)-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-[4-(azepan-1-ylsulfonyl)phenyl]-5-keto-N-(3-methyl-2-pyridyl)pyrrolidine-3-carboxamide Formula: C23H28N4O4S MolecularWeight: 456.55782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(N=CC=C1)NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H28N4O4S/c1-17-7-6-12-24-22(17)25-23(29)18-15-21(28)27(16-18)19-8-10-20(11-9-19)32(30,31)26-13-4-2-3-5-14-26/h6-12,18H,2-5,13-16H2,1H3,(H,24,25,29)