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

Systemtic Name: ethyl 5-cyano-2-methyl-6-[2-[methyl(thiophen-3-ylmethyl)amino]-2-oxidanylidene-ethyl]sulfanyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-methyl-6-[2-[methyl(3-thienylmethyl)amino]-2-oxo-ethyl]sulfanyl-pyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-6-[[2-[methyl(3-thiophenylmethyl)amino]-2-oxoethyl]thio]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-methyl-6-[2-[methyl(thiophen-3-ylmethyl)amino]-2-oxoethyl]sulfanylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-keto-2-[methyl(3-thenyl)amino]ethyl]thio]-2-methyl-nicotinic acid ethyl ester Formula: C18H19N3O3S2 MolecularWeight: 389.49176

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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=CSC=C2)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)N(C)CC2=CSC=C2)C

InChI

InChI=1S/C18H19N3O3S2/c1-4-24-18(23)15-7-14(8-19)17(20-12(15)2)26-11-16(22)21(3)9-13-5-6-25-10-13/h5-7,10H,4,9,11H2,1-3H3