ethyl 5-[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-5-[2-(2,4-dichlorophenoxy)propanoylamino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[2-(2,4-dichlorophenoxy)-1-oxopropyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[2-(2,4-dichlorophenoxy)propanoylamino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[2-(2,4-dichlorophenoxy)propanoylamino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C18H16Cl2N2O4S MolecularWeight: 427.30164

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C(C)OC2=C(C=C(C=C2)Cl)Cl)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C(C)OC2=C(C=C(C=C2)Cl)Cl)C#N)C

InChI

InChI=1S/C18H16Cl2N2O4S/c1-4-25-18(24)15-9(2)12(8-21)17(27-15)22-16(23)10(3)26-14-6-5-11(19)7-13(14)20/h5-7,10H,4H2,1-3H3,(H,22,23)