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

Systemtic Name: 3-[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]-N-propyl-benzamide Openeye Name: 3-[3-[4-(1-piperidylsulfonyl)phenyl]propanoylamino]-N-propyl-benzamide CAS Name: 3-[[1-oxo-3-[4-(1-piperidinylsulfonyl)phenyl]propyl]amino]-N-propylbenzamide IUPAC Name: 3-[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]-N-propylbenzamide Traditional Name: 3-[3-(4-piperidinosulfonylphenyl)propanoylamino]-N-propyl-benzamide Formula: C24H31N3O4S MolecularWeight: 457.58564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC(=CC=C1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCCNC(=O)C1=CC(=CC=C1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C24H31N3O4S/c1-2-15-25-24(29)20-7-6-8-21(18-20)26-23(28)14-11-19-9-12-22(13-10-19)32(30,31)27-16-4-3-5-17-27/h6-10,12-13,18H,2-5,11,14-17H2,1H3,(H,25,29)(H,26,28)