N-[3-[[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]methyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-[[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]methyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[3-[[3-[4-(1-piperidylsulfonyl)phenyl]propanoylamino]methyl]phenyl]cyclopropanecarboxamide CAS Name: N-[3-[[[1-oxo-3-[4-(1-piperidinylsulfonyl)phenyl]propyl]amino]methyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]methyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[3-[[3-(4-piperidinosulfonylphenyl)propanoylamino]methyl]phenyl]cyclopropanecarboxamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NCC3=CC(=CC=C3)NC(=O)C4CC4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NCC3=CC(=CC=C3)NC(=O)C4CC4

InChI

InChI=1S/C25H31N3O4S/c29-24(26-18-20-5-4-6-22(17-20)27-25(30)21-10-11-21)14-9-19-7-12-23(13-8-19)33(31,32)28-15-2-1-3-16-28/h4-8,12-13,17,21H,1-3,9-11,14-16,18H2,(H,26,29)(H,27,30)