ethyl 5-cyano-2-methyl-6-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2-methyl-6-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-methyl-6-[[5-(2-thienyl)isoxazol-3-yl]methylsulfanyl]pyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-6-[(5-thiophen-2-yl-3-isoxazolyl)methylthio]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-methyl-6-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxylate Traditional Name: 5-cyano-2-methyl-6-[[5-(2-thienyl)isoxazol-3-yl]methylthio]nicotinic acid ethyl ester Formula: C18H15N3O3S2 MolecularWeight: 385.46

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC2=NOC(=C2)C3=CC=CS3)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC2=NOC(=C2)C3=CC=CS3)C

InChI

InChI=1S/C18H15N3O3S2/c1-3-23-18(22)14-7-12(9-19)17(20-11(14)2)26-10-13-8-15(24-21-13)16-5-4-6-25-16/h4-8H,3,10H2,1-2H3