(2S)-2-(naphthalen-1-ylsulfonylamino)-5-oxidanylidene-5-[4-(3-piperidin-4-ylpropyl)piperidin-1-yl]pentanoic acid

Systemtic Name: (2S)-2-(naphthalen-1-ylsulfonylamino)-5-oxidanylidene-5-[4-(3-piperidin-4-ylpropyl)piperidin-1-yl]pentanoic acid Openeye Name: (2S)-2-(1-naphthylsulfonylamino)-5-oxo-5-[4-[3-(4-piperidyl)propyl]-1-piperidyl]pentanoic acid CAS Name: (2S)-2-(1-naphthalenylsulfonylamino)-5-oxo-5-[4-[3-(4-piperidinyl)propyl]-1-piperidinyl]pentanoic acid IUPAC Name: (2S)-2-(naphthalen-1-ylsulfonylamino)-5-oxo-5-[4-(3-piperidin-4-ylpropyl)piperidin-1-yl]pentanoic acid Traditional Name: (2S)-5-keto-2-(1-naphthylsulfonylamino)-5-[4-[3-(4-piperidyl)propyl]piperidino]valeric acid Formula: C28H39N3O5S MolecularWeight: 529.69136

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CCCC2CCN(CC2)C(=O)CCC(C(=O)O)NS(=O)(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CNCCC1CCCC2CCN(CC2)C(=O)CC[C@@H](C(=O)O)NS(=O)(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C28H39N3O5S/c32-27(31-19-15-22(16-20-31)6-3-5-21-13-17-29-18-14-21)12-11-25(28(33)34)30-37(35,36)26-10-4-8-23-7-1-2-9-24(23)26/h1-2,4,7-10,21-22,25,29-30H,3,5-6,11-20H2,(H,33,34)/t25-/m0/s1