N-[(4-cyanophenyl)methyl]-1-[3-oxidanyl-2-[(phenylmethyl)sulfonylamino]propanoyl]-2,5-dihydropyrrole-2-carboxamide

Systemtic Name: N-[(4-cyanophenyl)methyl]-1-[3-oxidanyl-2-[(phenylmethyl)sulfonylamino]propanoyl]-2,5-dihydropyrrole-2-carboxamide Openeye Name: 1-[2-(benzylsulfonylamino)-3-hydroxy-propanoyl]-N-[(4-cyanophenyl)methyl]-2,5-dihydropyrrole-2-carboxamide CAS Name: N-[(4-cyanophenyl)methyl]-1-[3-hydroxy-1-oxo-2-[(phenylmethyl)sulfonylamino]propyl]-2,5-dihydropyrrole-2-carboxamide IUPAC Name: 1-[2-(benzylsulfonylamino)-3-hydroxypropanoyl]-N-[(4-cyanophenyl)methyl]-2,5-dihydropyrrole-2-carboxamide Traditional Name: 1-[2-(benzylsulfonylamino)-3-hydroxy-propanoyl]-N-(4-cyanobenzyl)-3-pyrroline-2-carboxamide Formula: C23H24N4O5S MolecularWeight: 468.52546

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(N1C(=O)C(CO)NS(=O)(=O)CC2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1C=CC(N1C(=O)C(CO)NS(=O)(=O)CC2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H24N4O5S/c24-13-17-8-10-18(11-9-17)14-25-22(29)21-7-4-12-27(21)23(30)20(15-28)26-33(31,32)16-19-5-2-1-3-6-19/h1-11,20-21,26,28H,12,14-16H2,(H,25,29)