dimethyl 5-azanyl-3-[(2-chloranyl-5-methylsulfanyl-phenyl)carbonyloxymethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[(2-chloranyl-5-methylsulfanyl-phenyl)carbonyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[(2-chloro-5-methylsulfanyl-benzoyl)oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[[2-chloro-5-(methylthio)phenyl]-oxomethoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[(2-chloro-5-methylsulfanylbenzoyl)oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[2-chloro-5-(methylthio)benzoyl]oxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C17H16ClNO6S2 MolecularWeight: 429.89504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClNO6S2/c1-23-16(21)12-10(13(17(22)24-2)27-14(12)19)7-25-15(20)9-6-8(26-3)4-5-11(9)18/h4-6H,7,19H2,1-3H3