ethyl (2Z)-3-(2-ethoxyethyl)-2-thiophen-2-ylsulfonylimino-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl (2Z)-3-(2-ethoxyethyl)-2-thiophen-2-ylsulfonylimino-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl (2Z)-3-(2-ethoxyethyl)-2-(2-thienylsulfonylimino)-1,3-benzothiazole-6-carboxylate CAS Name: (2Z)-3-(2-ethoxyethyl)-2-thiophen-2-ylsulfonylimino-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl (2Z)-3-(2-ethoxyethyl)-2-thiophen-2-ylsulfonylimino-1,3-benzothiazole-6-carboxylate Traditional Name: (2Z)-3-(2-ethoxyethyl)-2-(2-thienylsulfonylimino)-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C18H20N2O5S3 MolecularWeight: 440.5568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCOCCN\1C2=C(C=C(C=C2)C(=O)OCC)S/C1=N\S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H20N2O5S3/c1-3-24-10-9-20-14-8-7-13(17(21)25-4-2)12-15(14)27-18(20)19-28(22,23)16-6-5-11-26-16/h5-8,11-12H,3-4,9-10H2,1-2H3/b19-18-