N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-4-(phenylmethyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-4-(phenylmethyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-benzylsulfonyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N-[4-(2-oxo-1-pyrrolidinyl)phenyl]-4-(phenylmethyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-benzylsulfonyl-N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-benzylsulfonyl-N-[4-(2-ketopyrrolidino)phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C26H25N3O5S MolecularWeight: 491.5588

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)C3CN(C4=CC=CC=C4O3)S(=O)(=O)CC5=CC=CC=C5

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)C3CN(C4=CC=CC=C4O3)S(=O)(=O)CC5=CC=CC=C5

InChI

InChI=1S/C26H25N3O5S/c30-25-11-6-16-28(25)21-14-12-20(13-15-21)27-26(31)24-17-29(22-9-4-5-10-23(22)34-24)35(32,33)18-19-7-2-1-3-8-19/h1-5,7-10,12-15,24H,6,11,16-18H2,(H,27,31)