ethyl 2-(naphthalen-2-ylsulfonylamino)-3-[(1-pyridin-4-ylpiperidin-4-yl)carbonylamino]propanoate

Systemtic Name: ethyl 2-(naphthalen-2-ylsulfonylamino)-3-[(1-pyridin-4-ylpiperidin-4-yl)carbonylamino]propanoate Openeye Name: ethyl 2-(2-naphthylsulfonylamino)-3-[[1-(4-pyridyl)piperidine-4-carbonyl]amino]propanoate CAS Name: 2-(2-naphthalenylsulfonylamino)-3-[[oxo-(1-pyridin-4-yl-4-piperidinyl)methyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 2-(naphthalen-2-ylsulfonylamino)-3-[(1-pyridin-4-ylpiperidine-4-carbonyl)amino]propanoate Traditional Name: 2-(2-naphthylsulfonylamino)-3-[[1-(4-pyridyl)isonipecotoyl]amino]propionic acid ethyl ester Formula: C26H30N4O5S MolecularWeight: 510.6052

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CNC(=O)C1CCN(CC1)C2=CC=NC=C2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCOC(=O)C(CNC(=O)C1CCN(CC1)C2=CC=NC=C2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H30N4O5S/c1-2-35-26(32)24(29-36(33,34)23-8-7-19-5-3-4-6-21(19)17-23)18-28-25(31)20-11-15-30(16-12-20)22-9-13-27-14-10-22/h3-10,13-14,17,20,24,29H,2,11-12,15-16,18H2,1H3,(H,28,31)