N-[3-(cyclopropylcarbonylamino)phenyl]-4-fluoranyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[3-(cyclopropylcarbonylamino)phenyl]-4-fluoranyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[3-(cyclopropanecarbonylamino)phenyl]-4-fluoro-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[3-[[cyclopropyl(oxo)methyl]amino]phenyl]-4-fluoro-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[3-(cyclopropanecarbonylamino)phenyl]-4-fluoro-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[3-(cyclopropanecarbonylamino)phenyl]-4-fluoro-3-piperidinosulfonyl-benzamide Formula: C22H24FN3O4S MolecularWeight: 445.507063

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC(=CC=C3)NC(=O)C4CC4)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC(=CC=C3)NC(=O)C4CC4)F

InChI

InChI=1S/C22H24FN3O4S/c23-19-10-9-16(13-20(19)31(29,30)26-11-2-1-3-12-26)22(28)25-18-6-4-5-17(14-18)24-21(27)15-7-8-15/h4-6,9-10,13-15H,1-3,7-8,11-12H2,(H,24,27)(H,25,28)