2-(3,3,5-trimethylcyclohexyl)-1,2-thiazol-3-one

Systemtic Name: 2-(3,3,5-trimethylcyclohexyl)-1,2-thiazol-3-one Openeye Name: 2-(3,3,5-trimethylcyclohexyl)isothiazol-3-one CAS Name: 2-(3,3,5-trimethylcyclohexyl)-3-isothiazolone IUPAC Name: 2-(3,3,5-trimethylcyclohexyl)-1,2-thiazol-3-one Traditional Name: 2-(3,3,5-trimethylcyclohexyl)-4-isothiazolin-3-one Formula: C12H19NOS MolecularWeight: 225.35036

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C)C)N2C(=O)C=CS2

Isomeric SMILES

CC1CC(CC(C1)(C)C)N2C(=O)C=CS2

InChI

InChI=1S/C12H19NOS/c1-9-6-10(8-12(2,3)7-9)13-11(14)4-5-15-13/h4-5,9-10H,6-8H2,1-3H3