3-methyl-6-pentyl-1,3-benzothiazol-2-one

Systemtic Name: 3-methyl-6-pentyl-1,3-benzothiazol-2-one Openeye Name: 3-methyl-6-pentyl-1,3-benzothiazol-2-one CAS Name: 3-methyl-6-pentyl-1,3-benzothiazol-2-one IUPAC Name: 3-methyl-6-pentyl-1,3-benzothiazol-2-one Traditional Name: 6-amyl-3-methyl-1,3-benzothiazol-2-one Formula: C13H17NOS MolecularWeight: 235.34518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C=C1)N(C(=O)S2)C

Isomeric SMILES

CCCCCC1=CC2=C(C=C1)N(C(=O)S2)C

InChI

InChI=1S/C13H17NOS/c1-3-4-5-6-10-7-8-11-12(9-10)16-13(15)14(11)2/h7-9H,3-6H2,1-2H3