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

Systemtic Name: ethyl 3-(2-ethoxyethyl)-2-[2-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]sulfanylethanoylimino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 3-(2-ethoxyethyl)-2-[2-[2-oxo-2-(thiazol-2-ylamino)ethyl]sulfanylacetyl]imino-1,3-benzothiazole-6-carboxylate CAS Name: 3-(2-ethoxyethyl)-2-[1-oxo-2-[[2-oxo-2-(2-thiazolylamino)ethyl]thio]ethyl]imino-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(2-ethoxyethyl)-2-[2-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanylacetyl]imino-1,3-benzothiazole-6-carboxylate Traditional Name: 3-(2-ethoxyethyl)-2-[2-[[2-keto-2-(thiazol-2-ylamino)ethyl]thio]acetyl]imino-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C21H24N4O5S3 MolecularWeight: 508.63406

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NC(=O)CSCC(=O)NC3=NC=CS3

Isomeric SMILES

CCOCCN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NC(=O)CSCC(=O)NC3=NC=CS3

InChI

InChI=1S/C21H24N4O5S3/c1-3-29-9-8-25-15-6-5-14(19(28)30-4-2)11-16(15)33-21(25)24-18(27)13-31-12-17(26)23-20-22-7-10-32-20/h5-7,10-11H,3-4,8-9,12-13H2,1-2H3,(H,22,23,26)