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

Systemtic Name: N-[3-[[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]methyl]phenyl]cyclobutanecarboxamide Openeye Name: N-[3-[[3-[4-(1-piperidylsulfonyl)phenyl]propanoylamino]methyl]phenyl]cyclobutanecarboxamide CAS Name: N-[3-[[[1-oxo-3-[4-(1-piperidinylsulfonyl)phenyl]propyl]amino]methyl]phenyl]cyclobutanecarboxamide IUPAC Name: N-[3-[[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]methyl]phenyl]cyclobutanecarboxamide Traditional Name: N-[3-[[3-(4-piperidinosulfonylphenyl)propanoylamino]methyl]phenyl]cyclobutanecarboxamide Formula: C26H33N3O4S MolecularWeight: 483.62292

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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)C4CCC4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NCC3=CC(=CC=C3)NC(=O)C4CCC4

InChI

InChI=1S/C26H33N3O4S/c30-25(27-19-21-6-4-9-23(18-21)28-26(31)22-7-5-8-22)15-12-20-10-13-24(14-11-20)34(32,33)29-16-2-1-3-17-29/h4,6,9-11,13-14,18,22H,1-3,5,7-8,12,15-17,19H2,(H,27,30)(H,28,31)