4-[2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 4-[2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-[2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-[2-oxo-2-[3-(1-pyrrolidinylsulfonyl)anilino]ethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-[2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-[2-keto-2-(3-pyrrolidinosulfonylanilino)ethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C21H24N4O5S MolecularWeight: 444.50406

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CN3CC(OC4=CC=CC=C43)C(=O)N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CN3CC(OC4=CC=CC=C43)C(=O)N

InChI

InChI=1S/C21H24N4O5S/c22-21(27)19-13-24(17-8-1-2-9-18(17)30-19)14-20(26)23-15-6-5-7-16(12-15)31(28,29)25-10-3-4-11-25/h1-2,5-9,12,19H,3-4,10-11,13-14H2,(H2,22,27)(H,23,26)