4-fluoranyl-N-[3-[methyl(phenyl)amino]propyl]-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-fluoranyl-N-[3-[methyl(phenyl)amino]propyl]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: 4-fluoro-N-[3-(N-methylanilino)propyl]-3-(1-piperidylsulfonyl)benzamide CAS Name: 4-fluoro-N-[3-(N-methylanilino)propyl]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: 4-fluoro-N-[3-(N-methylanilino)propyl]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 4-fluoro-N-[3-(N-methylanilino)propyl]-3-piperidinosulfonyl-benzamide Formula: C22H28FN3O3S MolecularWeight: 433.539423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1=CC(=C(C=C1)F)S(=O)(=O)N2CCCCC2)C3=CC=CC=C3

Isomeric SMILES

CN(CCCNC(=O)C1=CC(=C(C=C1)F)S(=O)(=O)N2CCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C22H28FN3O3S/c1-25(19-9-4-2-5-10-19)14-8-13-24-22(27)18-11-12-20(23)21(17-18)30(28,29)26-15-6-3-7-16-26/h2,4-5,9-12,17H,3,6-8,13-16H2,1H3,(H,24,27)