ethyl 5-cyano-2-methyl-6-[2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxidanylidene-ethyl]sulfanyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2-methyl-6-[2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxidanylidene-ethyl]sulfanyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-methyl-6-[2-[methyl-[(3-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]sulfanyl-pyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-6-[[2-[methyl-[(3-methyl-2-thiophenyl)methyl]amino]-2-oxoethyl]thio]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-methyl-6-[2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]sulfanylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-keto-2-[methyl-[(3-methyl-2-thienyl)methyl]amino]ethyl]thio]-2-methyl-nicotinic acid ethyl ester Formula: C19H21N3O3S2 MolecularWeight: 403.51834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)N(C)CC2=C(C=CS2)C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)N(C)CC2=C(C=CS2)C)C

InChI

InChI=1S/C19H21N3O3S2/c1-5-25-19(24)15-8-14(9-20)18(21-13(15)3)27-11-17(23)22(4)10-16-12(2)6-7-26-16/h6-8H,5,10-11H2,1-4H3