N-[[3-(2-methylpropanoylamino)phenyl]methyl]-2-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[[3-(2-methylpropanoylamino)phenyl]methyl]-2-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[[3-(2-methylpropanoylamino)phenyl]methyl]-2-(1-piperidylsulfonyl)benzamide CAS Name: N-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-2-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[[3-(2-methylpropanoylamino)phenyl]methyl]-2-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[3-(isobutyrylamino)benzyl]-2-piperidinosulfonyl-benzamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)C2=CC=CC=C2S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)C2=CC=CC=C2S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C23H29N3O4S/c1-17(2)22(27)25-19-10-8-9-18(15-19)16-24-23(28)20-11-4-5-12-21(20)31(29,30)26-13-6-3-7-14-26/h4-5,8-12,15,17H,3,6-7,13-14,16H2,1-2H3,(H,24,28)(H,25,27)