N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-2-(1-methylimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-2-(1-methylimidazol-2-yl)sulfanyl-propanamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-N-methyl-2-(1-methylimidazol-2-yl)sulfanyl-propanamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-N-methyl-2-[(1-methyl-2-imidazolyl)thio]propanamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-N-methyl-2-(1-methylimidazol-2-yl)sulfanylpropanamide Traditional Name: N-(1,1-diketothiolan-3-yl)-N-methyl-2-[(1-methylimidazol-2-yl)thio]propionamide Formula: C12H19N3O3S2 MolecularWeight: 317.42756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C1CCS(=O)(=O)C1)SC2=NC=CN2C

Isomeric SMILES

CC(C(=O)N(C)C1CCS(=O)(=O)C1)SC2=NC=CN2C

InChI

InChI=1S/C12H19N3O3S2/c1-9(19-12-13-5-6-14(12)2)11(16)15(3)10-4-7-20(17,18)8-10/h5-6,9-10H,4,7-8H2,1-3H3