1,3-benzothiazol-2-ylmethyl 2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-[(2-methylthiazol-4-yl)methylsulfanyl]benzoate CAS Name: 2-[(2-methyl-4-thiazolyl)methylthio]benzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzoate Traditional Name: 2-[(2-methylthiazol-4-yl)methylthio]benzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C20H16N2O2S3 MolecularWeight: 412.54824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSC2=CC=CC=C2C(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=NC(=CS1)CSC2=CC=CC=C2C(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H16N2O2S3/c1-13-21-14(11-25-13)12-26-17-8-4-2-6-15(17)20(23)24-10-19-22-16-7-3-5-9-18(16)27-19/h2-9,11H,10,12H2,1H3