methyl 2-(6-methylsulfonyl-2-thiophen-2-ylcarbonylimino-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: methyl 2-(6-methylsulfonyl-2-thiophen-2-ylcarbonylimino-1,3-benzothiazol-3-yl)ethanoate Openeye Name: methyl 2-[6-methylsulfonyl-2-(thiophene-2-carbonylimino)-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-methylsulfonyl-2-[oxo(thiophen-2-yl)methyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6-methylsulfonyl-2-(thiophene-2-carbonylimino)-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-mesyl-2-(2-thenoylimino)-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C16H14N2O5S3 MolecularWeight: 410.48776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C3=CC=CS3

Isomeric SMILES

COC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C3=CC=CS3

InChI

InChI=1S/C16H14N2O5S3/c1-23-14(19)9-18-11-6-5-10(26(2,21)22)8-13(11)25-16(18)17-15(20)12-4-3-7-24-12/h3-8H,9H2,1-2H3