N,N-diethylethanamine; [3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]carbamodithioic acid

Systemtic Name: N,N-diethylethanamine; [3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]carbamodithioic acid Openeye Name: N,N-diethylethanamine; (3-methyl-1,1-dioxo-thiolan-3-yl)carbamodithioic acid CAS Name: N,N-diethylethanamine; (3-methyl-1,1-dioxo-3-thiolanyl)carbamodithioic acid IUPAC Name: N,N-diethylethanamine; (3-methyl-1,1-dioxothiolan-3-yl)carbamodithioic acid Traditional Name: (1,1-diketo-3-methyl-thiolan-3-yl)carbamodithioic acid; triethylamine Formula: C12H26N2O2S3 MolecularWeight: 326.54204

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.CC1(CCS(=O)(=O)C1)NC(=S)S

Isomeric SMILES

CCN(CC)CC.CC1(CCS(=O)(=O)C1)NC(=S)S

InChI

InChI=1S/C6H11NO2S3.C6H15N/c1-6(7-5(10)11)2-3-12(8,9)4-6;1-4-7(5-2)6-3/h2-4H2,1H3,(H2,7,10,11);4-6H2,1-3H3