ethyl (1E)-N-[4-cyano-3-(2-methylpentan-2-yl)-1,2-thiazol-5-yl]methanimidate

Systemtic Name: ethyl (1E)-N-[4-cyano-3-(2-methylpentan-2-yl)-1,2-thiazol-5-yl]methanimidate Openeye Name: ethyl (1E)-N-[4-cyano-3-(1,1-dimethylbutyl)isothiazol-5-yl]methanimidate CAS Name: (1E)-N-[4-cyano-3-(2-methylpentan-2-yl)-5-isothiazolyl]methanimidic acid ethyl ester IUPAC Name: ethyl (1E)-N-[4-cyano-3-(2-methylpentan-2-yl)-1,2-thiazol-5-yl]methanimidate Traditional Name: (1E)-N-[4-cyano-3-(1,1-dimethylbutyl)isothiazol-5-yl]formimidic acid ethyl ester Formula: C13H19N3OS MolecularWeight: 265.37446

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)C1=NSC(=C1C#N)N=COCC

Isomeric SMILES

CCCC(C)(C)C1=NSC(=C1C#N)/N=C/OCC

InChI

InChI=1S/C13H19N3OS/c1-5-7-13(3,4)11-10(8-14)12(18-16-11)15-9-17-6-2/h9H,5-7H2,1-4H3/b15-9+