4-ethyl-5-(phenylmethyl)-1,2-thiazol-3-one

Systemtic Name: 4-ethyl-5-(phenylmethyl)-1,2-thiazol-3-one Openeye Name: 5-benzyl-4-ethyl-isothiazol-3-one CAS Name: 4-ethyl-5-(phenylmethyl)-3-isothiazolone IUPAC Name: 5-benzyl-4-ethyl-1,2-thiazol-3-one Traditional Name: 5-benzyl-4-ethyl-4-isothiazolin-3-one Formula: C12H13NOS MolecularWeight: 219.30272

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SNC1=O)CC2=CC=CC=C2

Isomeric SMILES

CCC1=C(SNC1=O)CC2=CC=CC=C2

InChI

InChI=1S/C12H13NOS/c1-2-10-11(15-13-12(10)14)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,13,14)