[2-[4-(3-acetamidopropyl)phenyl]-2-oxidanylidene-ethyl] 3-morpholin-4-ylsulfonylthiophene-2-carboxylate

Systemtic Name: [2-[4-(3-acetamidopropyl)phenyl]-2-oxidanylidene-ethyl] 3-morpholin-4-ylsulfonylthiophene-2-carboxylate Openeye Name: [2-[4-(3-acetamidopropyl)phenyl]-2-oxo-ethyl] 3-morpholinosulfonylthiophene-2-carboxylate CAS Name: 3-(4-morpholinylsulfonyl)-2-thiophenecarboxylic acid [2-[4-(3-acetamidopropyl)phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(3-acetamidopropyl)phenyl]-2-oxoethyl] 3-morpholin-4-ylsulfonylthiophene-2-carboxylate Traditional Name: 3-morpholinosulfonylthiophene-2-carboxylic acid [2-[4-(3-acetamidopropyl)phenyl]-2-keto-ethyl] ester Formula: C22H26N2O7S2 MolecularWeight: 494.58104

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCCC1=CC=C(C=C1)C(=O)COC(=O)C2=C(C=CS2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(=O)NCCCC1=CC=C(C=C1)C(=O)COC(=O)C2=C(C=CS2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C22H26N2O7S2/c1-16(25)23-9-2-3-17-4-6-18(7-5-17)19(26)15-31-22(27)21-20(8-14-32-21)33(28,29)24-10-12-30-13-11-24/h4-8,14H,2-3,9-13,15H2,1H3,(H,23,25)