2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethyl 4-ethyl-5-methyl-thiophene-2-carboxylate

Systemtic Name: 2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethyl 4-ethyl-5-methyl-thiophene-2-carboxylate Openeye Name: 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl 4-ethyl-5-methyl-thiophene-2-carboxylate CAS Name: 4-ethyl-5-methyl-2-thiophenecarboxylic acid 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl ester IUPAC Name: 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl 4-ethyl-5-methylthiophene-2-carboxylate Traditional Name: 4-ethyl-5-methyl-thiophene-2-carboxylic acid 2-(1,1,3-triketo-1,2-benzothiazol-2-yl)ethyl ester Formula: C17H17NO5S2 MolecularWeight: 379.45058

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1)C(=O)OCCN2C(=O)C3=CC=CC=C3S2(=O)=O)C

Isomeric SMILES

CCC1=C(SC(=C1)C(=O)OCCN2C(=O)C3=CC=CC=C3S2(=O)=O)C

InChI

InChI=1S/C17H17NO5S2/c1-3-12-10-14(24-11(12)2)17(20)23-9-8-18-16(19)13-6-4-5-7-15(13)25(18,21)22/h4-7,10H,3,8-9H2,1-2H3