methyl 5-[4-[2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoyl]piperazin-1-yl]sulfonylthiophene-3-carboxylate

Systemtic Name: methyl 5-[4-[2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoyl]piperazin-1-yl]sulfonylthiophene-3-carboxylate Openeye Name: methyl 5-[4-[2-(2-oxo-1,3-benzoxazol-3-yl)acetyl]piperazin-1-yl]sulfonylthiophene-3-carboxylate CAS Name: 5-[[4-[1-oxo-2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]-1-piperazinyl]sulfonyl]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[4-[2-(2-oxo-1,3-benzoxazol-3-yl)acetyl]piperazin-1-yl]sulfonylthiophene-3-carboxylate Traditional Name: 5-[4-[2-(2-keto-1,3-benzoxazol-3-yl)acetyl]piperazino]sulfonylthiophene-3-carboxylic acid methyl ester Formula: C19H19N3O7S2 MolecularWeight: 465.50006

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CSC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN3C4=CC=CC=C4OC3=O

Isomeric SMILES

COC(=O)C1=CSC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN3C4=CC=CC=C4OC3=O

InChI

InChI=1S/C19H19N3O7S2/c1-28-18(24)13-10-17(30-12-13)31(26,27)21-8-6-20(7-9-21)16(23)11-22-14-4-2-3-5-15(14)29-19(22)25/h2-5,10,12H,6-9,11H2,1H3