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

Systemtic Name: ethyl (2Z)-3-ethyl-2-thiophen-2-ylsulfonylimino-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl (2Z)-3-ethyl-2-(2-thienylsulfonylimino)-1,3-benzothiazole-6-carboxylate CAS Name: (2Z)-3-ethyl-2-thiophen-2-ylsulfonylimino-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl (2Z)-3-ethyl-2-thiophen-2-ylsulfonylimino-1,3-benzothiazole-6-carboxylate Traditional Name: (2Z)-3-ethyl-2-(2-thienylsulfonylimino)-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C16H16N2O4S3 MolecularWeight: 396.50424

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O4S3/c1-3-18-12-8-7-11(15(19)22-4-2)10-13(12)24-16(18)17-25(20,21)14-6-5-9-23-14/h5-10H,3-4H2,1-2H3/b17-16-