N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-(2-oxopyrrolidin-1-yl)benzamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-4-(2-oxo-1-pyrrolidinyl)benzamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-4-(2-oxopyrrolidin-1-yl)benzamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-(2-ketopyrrolidino)benzamide Formula: C24H29N3O4S MolecularWeight: 455.56976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)N3CCCC3=O)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)N3CCCC3=O)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C24H29N3O4S/c1-18-8-11-20(17-22(18)32(30,31)26-14-4-2-3-5-15-26)25-24(29)19-9-12-21(13-10-19)27-16-6-7-23(27)28/h8-13,17H,2-7,14-16H2,1H3,(H,25,29)