methyl 3-(2-ethoxyethyl)-2-[2-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]sulfonylethanoylimino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 3-(2-ethoxyethyl)-2-[2-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]sulfonylethanoylimino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 3-(2-ethoxyethyl)-2-[2-[2-oxo-2-(thiazol-2-ylamino)ethyl]sulfonylacetyl]imino-1,3-benzothiazole-6-carboxylate CAS Name: 3-(2-ethoxyethyl)-2-[1-oxo-2-[2-oxo-2-(2-thiazolylamino)ethyl]sulfonylethyl]imino-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 3-(2-ethoxyethyl)-2-[2-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfonylacetyl]imino-1,3-benzothiazole-6-carboxylate Traditional Name: 3-(2-ethoxyethyl)-2-[2-[2-keto-2-(thiazol-2-ylamino)ethyl]sulfonylacetyl]imino-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C20H22N4O7S3 MolecularWeight: 526.60628

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)CS(=O)(=O)CC(=O)NC3=NC=CS3

Isomeric SMILES

CCOCCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)CS(=O)(=O)CC(=O)NC3=NC=CS3

InChI

InChI=1S/C20H22N4O7S3/c1-3-31-8-7-24-14-5-4-13(18(27)30-2)10-15(14)33-20(24)23-17(26)12-34(28,29)11-16(25)22-19-21-6-9-32-19/h4-6,9-10H,3,7-8,11-12H2,1-2H3,(H,21,22,25)