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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=NS(=O)(=O)C3=CC=CS3)S2)CC(=O)OC

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(/C(=N/S(=O)(=O)C3=CC=CS3)/S2)CC(=O)OC

InChI

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