[(4-benzamidophenyl)sulfonylamino] 2-(pyridin-3-ylamino)propanoate

Systemtic Name: [(4-benzamidophenyl)sulfonylamino] 2-(pyridin-3-ylamino)propanoate Openeye Name: [(4-benzamidophenyl)sulfonylamino] 2-(3-pyridylamino)propanoate CAS Name: 2-(3-pyridinylamino)propanoic acid [(4-benzamidophenyl)sulfonylamino] ester IUPAC Name: [(4-benzamidophenyl)sulfonylamino] 2-(pyridin-3-ylamino)propanoate Traditional Name: 2-(3-pyridylamino)propionic acid [(4-benzamidophenyl)sulfonylamino] ester Formula: C21H20N4O5S MolecularWeight: 440.4723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)ONS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2)NC3=CN=CC=C3

Isomeric SMILES

CC(C(=O)ONS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2)NC3=CN=CC=C3

InChI

InChI=1S/C21H20N4O5S/c1-15(23-18-8-5-13-22-14-18)21(27)30-25-31(28,29)19-11-9-17(10-12-19)24-20(26)16-6-3-2-4-7-16/h2-15,23,25H,1H3,(H,24,26)