2-(2-adamantyl)-4-bromanyl-5-chloranyl-1,2-thiazol-3-one

Systemtic Name: 2-(2-adamantyl)-4-bromanyl-5-chloranyl-1,2-thiazol-3-one Openeye Name: 2-(2-adamantyl)-4-bromo-5-chloro-isothiazol-3-one CAS Name: 2-(2-adamantyl)-4-bromo-5-chloro-3-isothiazolone IUPAC Name: 2-(2-adamantyl)-4-bromo-5-chloro-1,2-thiazol-3-one Traditional Name: 2-(2-adamantyl)-4-bromo-5-chloro-4-isothiazolin-3-one Formula: C13H15BrClNOS MolecularWeight: 348.6863

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3N4C(=O)C(=C(S4)Cl)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)C3N4C(=O)C(=C(S4)Cl)Br

InChI

InChI=1S/C13H15BrClNOS/c14-10-12(15)18-16(13(10)17)11-8-2-6-1-7(4-8)5-9(11)3-6/h6-9,11H,1-5H2