7-chloranyl-5-methylsulfonyl-N-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide

Systemtic Name: 7-chloranyl-5-methylsulfonyl-N-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide Openeye Name: 7-chloro-5-methylsulfonyl-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide CAS Name: 7-chloro-5-methylsulfonyl-N-[[3-(2-oxo-1-pyrrolidinyl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide IUPAC Name: 7-chloro-5-methylsulfonyl-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide Traditional Name: 7-chloro-N-[3-(2-ketopyrrolidino)benzyl]-5-mesyl-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide Formula: C22H24ClN3O5S MolecularWeight: 477.96106

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(OC2=C1C=C(C=C2)Cl)C(=O)NCC3=CC(=CC=C3)N4CCCC4=O

Isomeric SMILES

CS(=O)(=O)N1CCC(OC2=C1C=C(C=C2)Cl)C(=O)NCC3=CC(=CC=C3)N4CCCC4=O

InChI

InChI=1S/C22H24ClN3O5S/c1-32(29,30)26-11-9-20(31-19-8-7-16(23)13-18(19)26)22(28)24-14-15-4-2-5-17(12-15)25-10-3-6-21(25)27/h2,4-5,7-8,12-13,20H,3,6,9-11,14H2,1H3,(H,24,28)