ethyl 2-[[(3-cyanophenyl)carbamoyl-(2-methoxyethyl)amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[(3-cyanophenyl)carbamoyl-(2-methoxyethyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[(3-cyanophenyl)carbamoyl-(2-methoxyethyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(3-cyanoanilino)-oxomethyl]-(2-methoxyethyl)amino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(3-cyanophenyl)carbamoyl-(2-methoxyethyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(3-cyanophenyl)carbamoyl-(2-methoxyethyl)amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C18H20N4O4S MolecularWeight: 388.4408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)CN(CCOC)C(=O)NC2=CC=CC(=C2)C#N

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)CN(CCOC)C(=O)NC2=CC=CC(=C2)C#N

InChI

InChI=1S/C18H20N4O4S/c1-3-26-17(23)15-12-27-16(21-15)11-22(7-8-25-2)18(24)20-14-6-4-5-13(9-14)10-19/h4-6,9,12H,3,7-8,11H2,1-2H3,(H,20,24)