(5-azanyl-4-cyano-2-ethoxycarbonyl-thiophen-3-yl)methyl 5,6-bis(chloranyl)pyridine-3-carboxylate

Systemtic Name: (5-azanyl-4-cyano-2-ethoxycarbonyl-thiophen-3-yl)methyl 5,6-bis(chloranyl)pyridine-3-carboxylate Openeye Name: (5-amino-4-cyano-2-ethoxycarbonyl-3-thienyl)methyl 5,6-dichloropyridine-3-carboxylate CAS Name: 5,6-dichloro-3-pyridinecarboxylic acid (5-amino-4-cyano-2-ethoxycarbonyl-3-thiophenyl)methyl ester IUPAC Name: (5-amino-4-cyano-2-ethoxycarbonylthiophen-3-yl)methyl 5,6-dichloropyridine-3-carboxylate Traditional Name: 5,6-dichloronicotinic acid (5-amino-2-carbethoxy-4-cyano-3-thienyl)methyl ester Formula: C15H11Cl2N3O4S MolecularWeight: 400.23654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC(=C(N=C2)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC(=C(N=C2)Cl)Cl

InChI

InChI=1S/C15H11Cl2N3O4S/c1-2-23-15(22)11-9(8(4-18)13(19)25-11)6-24-14(21)7-3-10(16)12(17)20-5-7/h3,5H,2,6,19H2,1H3