N-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)ethanoyl]phenyl]-N-methyl-methanesulfonamide

Systemtic Name: N-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)ethanoyl]phenyl]-N-methyl-methanesulfonamide Openeye Name: N-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetyl]phenyl]-N-methyl-methanesulfonamide CAS Name: N-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-1-oxoethyl]phenyl]-N-methylmethanesulfonamide IUPAC Name: N-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetyl]phenyl]-N-methylmethanesulfonamide Traditional Name: N-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)acetyl]phenyl]-N-methyl-methanesulfonamide Formula: C19H21NO5S2 MolecularWeight: 407.50374

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)C(=O)CSC2=CC3=C(C=C2)OCCCO3)S(=O)(=O)C

Isomeric SMILES

CN(C1=CC=C(C=C1)C(=O)CSC2=CC3=C(C=C2)OCCCO3)S(=O)(=O)C

InChI

InChI=1S/C19H21NO5S2/c1-20(27(2,22)23)15-6-4-14(5-7-15)17(21)13-26-16-8-9-18-19(12-16)25-11-3-10-24-18/h4-9,12H,3,10-11,13H2,1-2H3