N-[2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]-N-methyl-thiophene-2-sulfonamide

Systemtic Name: N-[2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]-N-methyl-thiophene-2-sulfonamide Openeye Name: N-[2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-2-oxo-ethyl]-N-methyl-thiophene-2-sulfonamide CAS Name: N-[2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-2-oxoethyl]-N-methyl-2-thiophenesulfonamide IUPAC Name: N-[2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-2-oxoethyl]-N-methylthiophene-2-sulfonamide Traditional Name: N-[2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]-2-keto-ethyl]-N-methyl-thiophene-2-sulfonamide Formula: C20H24N2O5S2 MolecularWeight: 436.54496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCCC1C2=CC3=C(C=C2)OCCCO3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CN(CC(=O)N1CCCC1C2=CC3=C(C=C2)OCCCO3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C20H24N2O5S2/c1-21(29(24,25)20-6-3-12-28-20)14-19(23)22-9-2-5-16(22)15-7-8-17-18(13-15)27-11-4-10-26-17/h3,6-8,12-13,16H,2,4-5,9-11,14H2,1H3