ethyl 4-[(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylmethyl]-2-(cyclopropylamino)-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-[(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylmethyl]-2-(cyclopropylamino)-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanylmethyl]-2-(cyclopropylamino)thiazole-5-carboxylate CAS Name: 4-[[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]methyl]-2-(cyclopropylamino)-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylmethyl]-2-(cyclopropylamino)-1,3-thiazole-5-carboxylate Traditional Name: 4-[[(3-cyano-4,6-dimethyl-2-pyridyl)thio]methyl]-2-(cyclopropylamino)thiazole-5-carboxylic acid ethyl ester Formula: C18H20N4O2S2 MolecularWeight: 388.507

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC2CC2)CSC3=C(C(=CC(=N3)C)C)C#N

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC2CC2)CSC3=C(C(=CC(=N3)C)C)C#N

InChI

InChI=1S/C18H20N4O2S2/c1-4-24-17(23)15-14(22-18(26-15)21-12-5-6-12)9-25-16-13(8-19)10(2)7-11(3)20-16/h7,12H,4-6,9H2,1-3H3,(H,21,22)