methyl (2Z)-3-(2-ethoxy-2-oxidanylidene-ethyl)-2-thiophen-2-ylsulfonylimino-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl (2Z)-3-(2-ethoxy-2-oxidanylidene-ethyl)-2-thiophen-2-ylsulfonylimino-1,3-benzothiazole-6-carboxylate Openeye Name: methyl (2Z)-3-(2-ethoxy-2-oxo-ethyl)-2-(2-thienylsulfonylimino)-1,3-benzothiazole-6-carboxylate CAS Name: (2Z)-3-(2-ethoxy-2-oxoethyl)-2-thiophen-2-ylsulfonylimino-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl (2Z)-3-(2-ethoxy-2-oxoethyl)-2-thiophen-2-ylsulfonylimino-1,3-benzothiazole-6-carboxylate Traditional Name: (2Z)-3-(2-ethoxy-2-keto-ethyl)-2-(2-thienylsulfonylimino)-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C17H16N2O6S3 MolecularWeight: 440.51374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)C(=O)OC)SC1=NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCOC(=O)CN\1C2=C(C=C(C=C2)C(=O)OC)S/C1=N\S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C17H16N2O6S3/c1-3-25-14(20)10-19-12-7-6-11(16(21)24-2)9-13(12)27-17(19)18-28(22,23)15-5-4-8-26-15/h4-9H,3,10H2,1-2H3/b18-17-