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

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]piperidine-3-carboxamide Openeye Name: 1-(4-fluorophenyl)sulfonyl-N-methyl-N-[2-(4-methylanilino)-2-oxo-ethyl]piperidine-3-carboxamide CAS Name: 1-(4-fluorophenyl)sulfonyl-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-fluorophenyl)sulfonyl-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]piperidine-3-carboxamide Traditional Name: 1-(4-fluorophenyl)sulfonyl-N-[2-keto-2-(p-toluidino)ethyl]-N-methyl-nipecotamide Formula: C22H26FN3O4S MolecularWeight: 447.522943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FN3O4S/c1-16-5-9-19(10-6-16)24-21(27)15-25(2)22(28)17-4-3-13-26(14-17)31(29,30)20-11-7-18(23)8-12-20/h5-12,17H,3-4,13-15H2,1-2H3,(H,24,27)