N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide

Systemtic Name: N-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide Openeye Name: N-(2-chloro-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-(3-oxo-1,4-benzoxazin-4-yl)acetamide CAS Name: N-[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-2-(3-oxo-1,4-benzoxazin-4-yl)acetamide IUPAC Name: N-(2-chloro-5-pyrrolidin-1-ylsulfonylphenyl)-2-(3-oxo-1,4-benzoxazin-4-yl)acetamide Traditional Name: N-(2-chloro-5-pyrrolidinosulfonyl-phenyl)-2-(3-keto-1,4-benzoxazin-4-yl)acetamide Formula: C20H20ClN3O5S MolecularWeight: 449.9079

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)CN3C(=O)COC4=CC=CC=C43

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)CN3C(=O)COC4=CC=CC=C43

InChI

InChI=1S/C20H20ClN3O5S/c21-15-8-7-14(30(27,28)23-9-3-4-10-23)11-16(15)22-19(25)12-24-17-5-1-2-6-18(17)29-13-20(24)26/h1-2,5-8,11H,3-4,9-10,12-13H2,(H,22,25)