(2Z)-2-(2-butyl-6-methyl-3-sulfanyl-2H-1,3-benzothiazol-4-yl)-2-methoxyimino-ethanoate

Systemtic Name: (2Z)-2-(2-butyl-6-methyl-3-sulfanyl-2H-1,3-benzothiazol-4-yl)-2-methoxyimino-ethanoate Openeye Name: (2Z)-2-(2-butyl-6-methyl-3-sulfanyl-2H-1,3-benzothiazol-4-yl)-2-methoxyimino-acetate CAS Name: (2Z)-2-(2-butyl-3-mercapto-6-methyl-2H-1,3-benzothiazol-4-yl)-2-methoxyiminoacetate IUPAC Name: (2Z)-2-(2-butyl-6-methyl-3-sulfanyl-2H-1,3-benzothiazol-4-yl)-2-methoxyiminoacetate Traditional Name: (2Z)-2-(2-butyl-3-mercapto-6-methyl-2H-1,3-benzothiazol-4-yl)-2-methyloximino-acetate Formula: C15H19N2O3S2- MolecularWeight: 339.45296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1N(C2=C(S1)C=C(C=C2C(=NOC)C(=O)[O-])C)S

Isomeric SMILES

CCCCC1N(C2=C(S1)C=C(C=C2/C(=N/OC)/C(=O)[O-])C)S

InChI

InChI=1S/C15H20N2O3S2/c1-4-5-6-12-17(21)14-10(13(15(18)19)16-20-3)7-9(2)8-11(14)22-12/h7-8,12,21H,4-6H2,1-3H3,(H,18,19)/p-1/b16-13-