1-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-[3,5-dimethyl-1,1-bis(oxidanylidene)-2H-1,2,6-thiadiazin-4-yl]ethanone

Systemtic Name: 1-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-[3,5-dimethyl-1,1-bis(oxidanylidene)-2H-1,2,6-thiadiazin-4-yl]ethanone Openeye Name: 1-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)ethanone CAS Name: 1-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)ethanone IUPAC Name: 1-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-(3,5-dimethyl-1,1-dioxo-2H-1,2,6-thiadiazin-4-yl)ethanone Traditional Name: 1-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2-(1,1-diketo-3,5-dimethyl-2H-1,2,6-thiadiazin-4-yl)ethanone Formula: C16H25N3O3S MolecularWeight: 339.453

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NS(=O)(=O)N1)C)CC(=O)N2CCC3CCCCC3C2

Isomeric SMILES

CC1=C(C(=NS(=O)(=O)N1)C)CC(=O)N2CC[C@H]3CCCC[C@@H]3C2

InChI

InChI=1S/C16H25N3O3S/c1-11-15(12(2)18-23(21,22)17-11)9-16(20)19-8-7-13-5-3-4-6-14(13)10-19/h13-14,17H,3-10H2,1-2H3/t13-,14-/m1/s1