methyl 4-[(4-morpholin-4-ylsulfonylphenyl)carbonylamino]-2,3-dihydrothiophene-5-carboxylate

Systemtic Name: methyl 4-[(4-morpholin-4-ylsulfonylphenyl)carbonylamino]-2,3-dihydrothiophene-5-carboxylate Openeye Name: methyl 4-[(4-morpholinosulfonylbenzoyl)amino]-2,3-dihydrothiophene-5-carboxylate CAS Name: 4-[[[4-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]-2,3-dihydrothiophene-5-carboxylic acid methyl ester IUPAC Name: methyl 4-[(4-morpholin-4-ylsulfonylbenzoyl)amino]-2,3-dihydrothiophene-5-carboxylate Traditional Name: 4-[(4-morpholinosulfonylbenzoyl)amino]-2,3-dihydrothiophene-5-carboxylic acid methyl ester Formula: C17H20N2O6S2 MolecularWeight: 412.4805

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(CCS1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC(=O)C1=C(CCS1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C17H20N2O6S2/c1-24-17(21)15-14(6-11-26-15)18-16(20)12-2-4-13(5-3-12)27(22,23)19-7-9-25-10-8-19/h2-5H,6-11H2,1H3,(H,18,20)