N-[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(3-fluoroanilino)-2-oxo-ethyl]-N-methyl-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-(3-fluoroanilino)-2-oxoethyl]-N-methyl-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(3-fluoroanilino)-2-oxoethyl]-N-methyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(3-fluoroanilino)-2-keto-ethyl]-N-methyl-1-(2-thienylsulfonyl)isonipecotamide Formula: C19H22FN3O4S2 MolecularWeight: 439.524083

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC(=CC=C1)F)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN(CC(=O)NC1=CC(=CC=C1)F)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C19H22FN3O4S2/c1-22(13-17(24)21-16-5-2-4-15(20)12-16)19(25)14-7-9-23(10-8-14)29(26,27)18-6-3-11-28-18/h2-6,11-12,14H,7-10,13H2,1H3,(H,21,24)