5-oxidanylidene-2-[(4-phenylphenyl)sulfonylamino]-5-(pyridin-4-ylamino)pentanoic acid

Systemtic Name: 5-oxidanylidene-2-[(4-phenylphenyl)sulfonylamino]-5-(pyridin-4-ylamino)pentanoic acid Openeye Name: 5-oxo-2-[(4-phenylphenyl)sulfonylamino]-5-(4-pyridylamino)pentanoic acid CAS Name: 5-oxo-2-[(4-phenylphenyl)sulfonylamino]-5-(pyridin-4-ylamino)pentanoic acid IUPAC Name: 5-oxo-2-[(4-phenylphenyl)sulfonylamino]-5-(pyridin-4-ylamino)pentanoic acid Traditional Name: 5-keto-2-[(4-phenylphenyl)sulfonylamino]-5-(4-pyridylamino)valeric acid Formula: C22H21N3O5S MolecularWeight: 439.48424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)NC(CCC(=O)NC3=CC=NC=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)NC(CCC(=O)NC3=CC=NC=C3)C(=O)O

InChI

InChI=1S/C22H21N3O5S/c26-21(24-18-12-14-23-15-13-18)11-10-20(22(27)28)25-31(29,30)19-8-6-17(7-9-19)16-4-2-1-3-5-16/h1-9,12-15,20,25H,10-11H2,(H,27,28)(H,23,24,26)