2-(naphthalen-2-ylsulfonylamino)-N-[1-oxidanylidene-1-piperidin-1-yl-3-[2-(4-pyridin-4-ylpiperazin-1-yl)ethanoylamino]propan-2-yl]ethanamide

Systemtic Name: 2-(naphthalen-2-ylsulfonylamino)-N-[1-oxidanylidene-1-piperidin-1-yl-3-[2-(4-pyridin-4-ylpiperazin-1-yl)ethanoylamino]propan-2-yl]ethanamide Openeye Name: 2-(2-naphthylsulfonylamino)-N-[2-oxo-2-(1-piperidyl)-1-[[[2-[4-(4-pyridyl)piperazin-1-yl]acetyl]amino]methyl]ethyl]acetamide CAS Name: 2-(2-naphthalenylsulfonylamino)-N-[1-oxo-3-[[1-oxo-2-(4-pyridin-4-yl-1-piperazinyl)ethyl]amino]-1-(1-piperidinyl)propan-2-yl]acetamide IUPAC Name: 2-(naphthalen-2-ylsulfonylamino)-N-[1-oxo-1-piperidin-1-yl-3-[[2-(4-pyridin-4-ylpiperazin-1-yl)acetyl]amino]propan-2-yl]acetamide Traditional Name: N-[2-keto-2-piperidino-1-[[[2-[4-(4-pyridyl)piperazino]acetyl]amino]methyl]ethyl]-2-(2-naphthylsulfonylamino)acetamide Formula: C31H39N7O5S MolecularWeight: 621.75026

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(CNC(=O)CN2CCN(CC2)C3=CC=NC=C3)NC(=O)CNS(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CCN(CC1)C(=O)C(CNC(=O)CN2CCN(CC2)C3=CC=NC=C3)NC(=O)CNS(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C31H39N7O5S/c39-29(22-34-44(42,43)27-9-8-24-6-2-3-7-25(24)20-27)35-28(31(41)38-14-4-1-5-15-38)21-33-30(40)23-36-16-18-37(19-17-36)26-10-12-32-13-11-26/h2-3,6-13,20,28,34H,1,4-5,14-19,21-23H2,(H,33,40)(H,35,39)