5-methyl-1,1-bis(oxidanylidene)-4-propyl-1,2-thiazol-3-one

Systemtic Name: 5-methyl-1,1-bis(oxidanylidene)-4-propyl-1,2-thiazol-3-one Openeye Name: 5-methyl-1,1-dioxo-4-propyl-isothiazol-3-one CAS Name: 5-methyl-1,1-dioxo-4-propyl-3-isothiazolone IUPAC Name: 5-methyl-1,1-dioxo-4-propyl-1,2-thiazol-3-one Traditional Name: 1,1-diketo-5-methyl-4-propyl-isothiazol-3-one Formula: C7H11NO3S MolecularWeight: 189.23214

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(S(=O)(=O)NC1=O)C

Isomeric SMILES

CCCC1=C(S(=O)(=O)NC1=O)C

InChI

InChI=1S/C7H11NO3S/c1-3-4-6-5(2)12(10,11)8-7(6)9/h3-4H2,1-2H3,(H,8,9)