2-(phenylmethyl)thieno[2,3-d][1,2]thiazol-3-one

Systemtic Name: 2-(phenylmethyl)thieno[2,3-d][1,2]thiazol-3-one Openeye Name: 2-benzylthieno[2,3-d]isothiazol-3-one CAS Name: 2-(phenylmethyl)-3-thieno[2,3-d]isothiazolone IUPAC Name: 2-benzylthieno[2,3-d][1,2]thiazol-3-one Traditional Name: 2-benzylthien[2,3-d]isothiazol-3-one Formula: C12H9NOS2 MolecularWeight: 247.33596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(S2)C=CS3

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(S2)C=CS3

InChI

InChI=1S/C12H9NOS2/c14-12-11-10(6-7-15-11)16-13(12)8-9-4-2-1-3-5-9/h1-7H,8H2