ethyl 4-cyano-5-[3-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylpropanoylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-5-[3-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylpropanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-5-[3-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]propanoylamino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[3-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-1-oxopropyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[3-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylpropanoylamino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[3-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]propanoylamino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C20H20N4O3S2 MolecularWeight: 428.5278

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)CCSC2=C(C(=CC(=N2)C)C)C#N)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)CCSC2=C(C(=CC(=N2)C)C)C#N)C#N)C

InChI

InChI=1S/C20H20N4O3S2/c1-5-27-20(26)17-13(4)15(10-22)19(29-17)24-16(25)6-7-28-18-14(9-21)11(2)8-12(3)23-18/h8H,5-7H2,1-4H3,(H,24,25)