5-butyl-2-methyl-1,2-benzothiazol-3-one

Systemtic Name: 5-butyl-2-methyl-1,2-benzothiazol-3-one Openeye Name: 5-butyl-2-methyl-1,2-benzothiazol-3-one CAS Name: 5-butyl-2-methyl-1,2-benzothiazol-3-one IUPAC Name: 5-butyl-2-methyl-1,2-benzothiazol-3-one Traditional Name: 5-butyl-2-methyl-1,2-benzothiazol-3-one Formula: C12H15NOS MolecularWeight: 221.3186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)SN(C2=O)C

Isomeric SMILES

CCCCC1=CC2=C(C=C1)SN(C2=O)C

InChI

InChI=1S/C12H15NOS/c1-3-4-5-9-6-7-11-10(8-9)12(14)13(2)15-11/h6-8H,3-5H2,1-2H3