propyl 2-[[5-(3-phenylpropylsulfonylcarbamoyl)pyridin-2-yl]carbonylamino]ethanoate

Systemtic Name: propyl 2-[[5-(3-phenylpropylsulfonylcarbamoyl)pyridin-2-yl]carbonylamino]ethanoate Openeye Name: propyl 2-[[5-(3-phenylpropylsulfonylcarbamoyl)pyridine-2-carbonyl]amino]acetate CAS Name: 2-[[oxo-[5-[oxo-(3-phenylpropylsulfonylamino)methyl]-2-pyridinyl]methyl]amino]acetic acid propyl ester IUPAC Name: propyl 2-[[5-(3-phenylpropylsulfonylcarbamoyl)pyridine-2-carbonyl]amino]acetate Traditional Name: 2-[[5-(3-phenylpropylsulfonylcarbamoyl)picolinoyl]amino]acetic acid propyl ester Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CNC(=O)C1=NC=C(C=C1)C(=O)NS(=O)(=O)CCCC2=CC=CC=C2

Isomeric SMILES

CCCOC(=O)CNC(=O)C1=NC=C(C=C1)C(=O)NS(=O)(=O)CCCC2=CC=CC=C2

InChI

InChI=1S/C21H25N3O6S/c1-2-12-30-19(25)15-23-21(27)18-11-10-17(14-22-18)20(26)24-31(28,29)13-6-9-16-7-4-3-5-8-16/h3-5,7-8,10-11,14H,2,6,9,12-13,15H2,1H3,(H,23,27)(H,24,26)