4-chloranyl-2-(phenylmethyl)-1,2-thiazol-3-one

Systemtic Name: 4-chloranyl-2-(phenylmethyl)-1,2-thiazol-3-one Openeye Name: 2-benzyl-4-chloro-isothiazol-3-one CAS Name: 4-chloro-2-(phenylmethyl)-3-isothiazolone IUPAC Name: 2-benzyl-4-chloro-1,2-thiazol-3-one Traditional Name: 2-benzyl-4-chloro-4-isothiazolin-3-one Formula: C10H8ClNOS MolecularWeight: 225.69462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C(=CS2)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C(=CS2)Cl

InChI

InChI=1S/C10H8ClNOS/c11-9-7-14-12(10(9)13)6-8-4-2-1-3-5-8/h1-5,7H,6H2