dimethyl 3-methyl-5-[(4-morpholin-4-ylsulfonylphenyl)carbonylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-[(4-morpholin-4-ylsulfonylphenyl)carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[(4-morpholinosulfonylbenzoyl)amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[[4-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[(4-morpholin-4-ylsulfonylbenzoyl)amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[(4-morpholinosulfonylbenzoyl)amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C20H22N2O8S2 MolecularWeight: 482.52728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)OC

InChI

InChI=1S/C20H22N2O8S2/c1-12-15(19(24)28-2)18(31-16(12)20(25)29-3)21-17(23)13-4-6-14(7-5-13)32(26,27)22-8-10-30-11-9-22/h4-7H,8-11H2,1-3H3,(H,21,23)