(4-methoxy-2-methoxycarbonyl-4-oxidanylidene-butanethioyl)-di(propan-2-yl)-sulfanyl-azanium

Systemtic Name: (4-methoxy-2-methoxycarbonyl-4-oxidanylidene-butanethioyl)-di(propan-2-yl)-sulfanyl-azanium Openeye Name: diisopropyl-(4-methoxy-2-methoxycarbonyl-4-oxo-butanethioyl)-sulfanyl-ammonium CAS Name: mercapto-(4-methoxy-2-methoxycarbonyl-4-oxo-1-sulfanylidenebutyl)-di(propan-2-yl)ammonium IUPAC Name: (4-methoxy-2-methoxycarbonyl-4-oxobutanethioyl)-di(propan-2-yl)-sulfanylazanium Traditional Name: (2-carbomethoxy-4-keto-4-methoxy-butanethioyl)-diisopropyl-mercapto-ammonium Formula: C13H24NO4S2+ MolecularWeight: 322.46396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+](C(C)C)(C(=S)C(CC(=O)OC)C(=O)OC)S

Isomeric SMILES

CC(C)[N+](C(C)C)(C(=S)C(CC(=O)OC)C(=O)OC)S

InChI

InChI=1S/C13H24NO4S2/c1-8(2)14(20,9(3)4)12(19)10(13(16)18-6)7-11(15)17-5/h8-10,20H,7H2,1-6H3/q+1