barium(2+); N-[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-N-prop-2-enyl-carbamodithioate

Systemtic Name: barium(2+); N-[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-N-prop-2-enyl-carbamodithioate Openeye Name: N-allyl-N-(3-methyl-1,1-dioxo-thiolan-3-yl)carbamodithioate; barium(2+) CAS Name: barium(2+); N-(3-methyl-1,1-dioxo-3-thiolanyl)-N-prop-2-enylcarbamodithioate IUPAC Name: barium(2+); N-(3-methyl-1,1-dioxothiolan-3-yl)-N-prop-2-enylcarbamodithioate Traditional Name: N-allyl-N-(1,1-diketo-3-methyl-thiolan-3-yl)carbamodithioate; barium(2+) Formula: C18H28BaN2O4S6 MolecularWeight: 666.14292

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCS(=O)(=O)C1)N(CC=C)C(=S)[S-].CC1(CCS(=O)(=O)C1)N(CC=C)C(=S)[S-].[Ba+2]

Isomeric SMILES

CC1(CCS(=O)(=O)C1)N(CC=C)C(=S)[S-].CC1(CCS(=O)(=O)C1)N(CC=C)C(=S)[S-].[Ba+2]

InChI

InChI=1S/2C9H15NO2S3.Ba/c2*1-3-5-10(8(13)14)9(2)4-6-15(11,12)7-9;/h2*3H,1,4-7H2,2H3,(H,13,14);/q;;+2/p-2