4-fluoranyl-N-[2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-fluoranyl-N-[2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: 4-fluoro-N-[2-(2-methoxy-5-methyl-anilino)-2-oxo-ethyl]-3-(1-piperidylsulfonyl)benzamide CAS Name: 4-fluoro-N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: 4-fluoro-N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 4-fluoro-N-[2-keto-2-(2-methoxy-5-methyl-anilino)ethyl]-3-piperidinosulfonyl-benzamide Formula: C22H26FN3O5S MolecularWeight: 463.522343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)CNC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)CNC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H26FN3O5S/c1-15-6-9-19(31-2)18(12-15)25-21(27)14-24-22(28)16-7-8-17(23)20(13-16)32(29,30)26-10-4-3-5-11-26/h6-9,12-13H,3-5,10-11,14H2,1-2H3,(H,24,28)(H,25,27)