1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-2-(4-methyl-2-methylsulfanyl-1,3-thiazol-5-yl)ethanone

Systemtic Name: 1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-2-(4-methyl-2-methylsulfanyl-1,3-thiazol-5-yl)ethanone Openeye Name: 1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-2-(4-methyl-2-methylsulfanyl-thiazol-5-yl)ethanone CAS Name: 1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-2-[4-methyl-2-(methylthio)-5-thiazolyl]ethanone IUPAC Name: 1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-2-(4-methyl-2-methylsulfanyl-1,3-thiazol-5-yl)ethanone Traditional Name: 1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]-2-[4-methyl-2-(methylthio)thiazol-5-yl]ethanone Formula: C20H24N2O3S2 MolecularWeight: 404.54616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SC)CC(=O)N2CCCC2C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=C(SC(=N1)SC)CC(=O)N2CCCC2C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C20H24N2O3S2/c1-13-18(27-20(21-13)26-2)12-19(23)22-8-3-5-15(22)14-6-7-16-17(11-14)25-10-4-9-24-16/h6-7,11,15H,3-5,8-10,12H2,1-2H3