N-[3-(cyclopropylcarbamoyl)phenyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-(cyclopropylcarbamoyl)phenyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-(cyclopropylcarbamoyl)phenyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[3-[(cyclopropylamino)-oxomethyl]phenyl]-1-(4-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-(cyclopropylcarbamoyl)phenyl]-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(cyclopropylcarbamoyl)phenyl]-1-(4-fluorophenyl)sulfonyl-isonipecotamide Formula: C22H24FN3O4S MolecularWeight: 445.507063

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H24FN3O4S/c23-17-4-8-20(9-5-17)31(29,30)26-12-10-15(11-13-26)21(27)25-19-3-1-2-16(14-19)22(28)24-18-6-7-18/h1-5,8-9,14-15,18H,6-7,10-13H2,(H,24,28)(H,25,27)