dimethyl 5-azanyl-3-[2-[(3-cyanophenyl)sulfonylamino]ethanoyloxymethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[2-[(3-cyanophenyl)sulfonylamino]ethanoyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[[2-[(3-cyanophenyl)sulfonylamino]acetyl]oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[2-[(3-cyanophenyl)sulfonylamino]-1-oxoethoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[[2-[(3-cyanophenyl)sulfonylamino]acetyl]oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[2-[(3-cyanophenyl)sulfonylamino]acetyl]oxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C18H17N3O8S2 MolecularWeight: 467.47288

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1COC(=O)CNS(=O)(=O)C2=CC=CC(=C2)C#N)C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(SC(=C1COC(=O)CNS(=O)(=O)C2=CC=CC(=C2)C#N)C(=O)OC)N

InChI

InChI=1S/C18H17N3O8S2/c1-27-17(23)14-12(15(18(24)28-2)30-16(14)20)9-29-13(22)8-21-31(25,26)11-5-3-4-10(6-11)7-19/h3-6,21H,8-9,20H2,1-2H3