4-fluoranyl-N-[2-(2-methylpropanoylamino)ethyl]-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-fluoranyl-N-[2-(2-methylpropanoylamino)ethyl]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: 4-fluoro-N-[2-(2-methylpropanoylamino)ethyl]-3-(1-piperidylsulfonyl)benzamide CAS Name: 4-fluoro-N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: 4-fluoro-N-[2-(2-methylpropanoylamino)ethyl]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 4-fluoro-N-[2-(isobutyrylamino)ethyl]-3-piperidinosulfonyl-benzamide Formula: C18H26FN3O4S MolecularWeight: 399.480143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C1=CC(=C(C=C1)F)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)C1=CC(=C(C=C1)F)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C18H26FN3O4S/c1-13(2)17(23)20-8-9-21-18(24)14-6-7-15(19)16(12-14)27(25,26)22-10-4-3-5-11-22/h6-7,12-13H,3-5,8-11H2,1-2H3,(H,20,23)(H,21,24)