propyl 2-[(6-acetamido-1,3-benzothiazol-2-yl)sulfanyl]ethanoate

Systemtic Name: propyl 2-[(6-acetamido-1,3-benzothiazol-2-yl)sulfanyl]ethanoate Openeye Name: propyl 2-[(6-acetamido-1,3-benzothiazol-2-yl)sulfanyl]acetate CAS Name: 2-[(6-acetamido-1,3-benzothiazol-2-yl)thio]acetic acid propyl ester IUPAC Name: propyl 2-[(6-acetamido-1,3-benzothiazol-2-yl)sulfanyl]acetate Traditional Name: 2-[(6-acetamido-1,3-benzothiazol-2-yl)thio]acetic acid propyl ester Formula: C14H16N2O3S2 MolecularWeight: 324.41844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C

Isomeric SMILES

CCCOC(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C

InChI

InChI=1S/C14H16N2O3S2/c1-3-6-19-13(18)8-20-14-16-11-5-4-10(15-9(2)17)7-12(11)21-14/h4-5,7H,3,6,8H2,1-2H3,(H,15,17)