dimethyl 5-azanyl-3-[2-(thiophen-2-ylmethylsulfanyl)ethanoyloxymethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[2-(thiophen-2-ylmethylsulfanyl)ethanoyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[[2-(2-thienylmethylsulfanyl)acetyl]oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[1-oxo-2-(thiophen-2-ylmethylthio)ethoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[[2-(thiophen-2-ylmethylsulfanyl)acetyl]oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[2-(2-thenylthio)acetyl]oxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C16H17NO6S3 MolecularWeight: 415.50428

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1COC(=O)CSCC2=CC=CS2)C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(SC(=C1COC(=O)CSCC2=CC=CS2)C(=O)OC)N

InChI

InChI=1S/C16H17NO6S3/c1-21-15(19)12-10(13(16(20)22-2)26-14(12)17)6-23-11(18)8-24-7-9-4-3-5-25-9/h3-5H,6-8,17H2,1-2H3