ethyl 5-cyano-2-methyl-4-(4-methyl-1,3-thiazol-5-yl)-6-[2-oxidanylidene-2-(thiophen-2-ylamino)ethyl]sulfanyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2-methyl-4-(4-methyl-1,3-thiazol-5-yl)-6-[2-oxidanylidene-2-(thiophen-2-ylamino)ethyl]sulfanyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-methyl-4-(4-methylthiazol-5-yl)-6-[2-oxo-2-(2-thienylamino)ethyl]sulfanyl-pyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-4-(4-methyl-5-thiazolyl)-6-[[2-oxo-2-(thiophen-2-ylamino)ethyl]thio]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-methyl-4-(4-methyl-1,3-thiazol-5-yl)-6-[2-oxo-2-(thiophen-2-ylamino)ethyl]sulfanylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-keto-2-(2-thienylamino)ethyl]thio]-2-methyl-4-(4-methylthiazol-5-yl)nicotinic acid ethyl ester Formula: C20H18N4O3S3 MolecularWeight: 458.57692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1C2=C(N=CS2)C)C#N)SCC(=O)NC3=CC=CS3)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1C2=C(N=CS2)C)C#N)SCC(=O)NC3=CC=CS3)C

InChI

InChI=1S/C20H18N4O3S3/c1-4-27-20(26)16-11(2)23-19(29-9-14(25)24-15-6-5-7-28-15)13(8-21)17(16)18-12(3)22-10-30-18/h5-7,10H,4,9H2,1-3H3,(H,24,25)