methyl 5-[3-(4-morpholin-4-ylsulfonylphenyl)propanoylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 5-[3-(4-morpholin-4-ylsulfonylphenyl)propanoylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 5-[3-(4-morpholinosulfonylphenyl)propanoylamino]benzothiophene-2-carboxylate CAS Name: 5-[[3-[4-(4-morpholinylsulfonyl)phenyl]-1-oxopropyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-[3-(4-morpholin-4-ylsulfonylphenyl)propanoylamino]-1-benzothiophene-2-carboxylate Traditional Name: 5-[3-(4-morpholinosulfonylphenyl)propanoylamino]benzothiophene-2-carboxylic acid methyl ester Formula: C23H24N2O6S2 MolecularWeight: 488.57646

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(S1)C=CC(=C2)NC(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC(=O)C1=CC2=C(S1)C=CC(=C2)NC(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C23H24N2O6S2/c1-30-23(27)21-15-17-14-18(5-8-20(17)32-21)24-22(26)9-4-16-2-6-19(7-3-16)33(28,29)25-10-12-31-13-11-25/h2-3,5-8,14-15H,4,9-13H2,1H3,(H,24,26)