dimethyl 5-azanyl-3-[(3-chloranylpyridin-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[(3-chloranylpyridin-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[(3-chloro-2-pyridyl)sulfanylmethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[(3-chloro-2-pyridinyl)thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[(3-chloropyridin-2-yl)sulfanylmethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[(3-chloro-2-pyridyl)thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C14H13ClN2O4S2 MolecularWeight: 372.84702

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1CSC2=C(C=CC=N2)Cl)C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(SC(=C1CSC2=C(C=CC=N2)Cl)C(=O)OC)N

InChI

InChI=1S/C14H13ClN2O4S2/c1-20-13(18)9-7(10(14(19)21-2)23-11(9)16)6-22-12-8(15)4-3-5-17-12/h3-5H,6,16H2,1-2H3