6-chloranyl-N-[4-methyl-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 6-chloranyl-N-[4-methyl-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 6-chloro-N-[4-methyl-3-(2-oxopyrrolidin-1-yl)phenyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 6-chloro-N-[4-methyl-3-(2-oxo-1-pyrrolidinyl)phenyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 6-chloro-N-[4-methyl-3-(2-oxopyrrolidin-1-yl)phenyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 6-chloro-N-[3-(2-ketopyrrolidino)-4-methyl-phenyl]-4-mesyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C21H22ClN3O5S MolecularWeight: 463.93448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CN(C3=C(O2)C=CC(=C3)Cl)S(=O)(=O)C)N4CCCC4=O

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CN(C3=C(O2)C=CC(=C3)Cl)S(=O)(=O)C)N4CCCC4=O

InChI

InChI=1S/C21H22ClN3O5S/c1-13-5-7-15(11-16(13)24-9-3-4-20(24)26)23-21(27)19-12-25(31(2,28)29)17-10-14(22)6-8-18(17)30-19/h5-8,10-11,19H,3-4,9,12H2,1-2H3,(H,23,27)