N-[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-N,4-dimethyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-N,4-dimethyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(3-fluoroanilino)-2-oxo-ethyl]-N,4-dimethyl-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[2-(3-fluoroanilino)-2-oxoethyl]-N,4-dimethyl-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[2-(3-fluoroanilino)-2-oxoethyl]-N,4-dimethyl-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(3-fluoroanilino)-2-keto-ethyl]-N,4-dimethyl-3-piperidinosulfonyl-benzamide Formula: C22H26FN3O4S MolecularWeight: 447.522943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(C)CC(=O)NC2=CC(=CC=C2)F)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(C)CC(=O)NC2=CC(=CC=C2)F)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H26FN3O4S/c1-16-9-10-17(13-20(16)31(29,30)26-11-4-3-5-12-26)22(28)25(2)15-21(27)24-19-8-6-7-18(23)14-19/h6-10,13-14H,3-5,11-12,15H2,1-2H3,(H,24,27)