N-methyl-3-[[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]methyl]benzamide

Systemtic Name: N-methyl-3-[[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]methyl]benzamide Openeye Name: N-methyl-3-[[3-[4-(1-piperidylsulfonyl)phenyl]propanoylamino]methyl]benzamide CAS Name: N-methyl-3-[[[1-oxo-3-[4-(1-piperidinylsulfonyl)phenyl]propyl]amino]methyl]benzamide IUPAC Name: N-methyl-3-[[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]methyl]benzamide Traditional Name: N-methyl-3-[[3-(4-piperidinosulfonylphenyl)propanoylamino]methyl]benzamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC=C1)CNC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CNC(=O)C1=CC(=CC=C1)CNC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C23H29N3O4S/c1-24-23(28)20-7-5-6-19(16-20)17-25-22(27)13-10-18-8-11-21(12-9-18)31(29,30)26-14-3-2-4-15-26/h5-9,11-12,16H,2-4,10,13-15,17H2,1H3,(H,24,28)(H,25,27)