ethyl 5-methyl-2-[2-(4-methylphenoxy)ethanoylcarbamothioylamino]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-2-[2-(4-methylphenoxy)ethanoylcarbamothioylamino]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 5-methyl-2-[[2-(4-methylphenoxy)acetyl]carbamothioylamino]thiazole-4-carboxylate CAS Name: 5-methyl-2-[[[[2-(4-methylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-2-[[2-(4-methylphenoxy)acetyl]carbamothioylamino]-1,3-thiazole-4-carboxylate Traditional Name: 5-methyl-2-[[2-(4-methylphenoxy)acetyl]thiocarbamoylamino]thiazole-4-carboxylic acid ethyl ester Formula: C17H19N3O4S2 MolecularWeight: 393.48046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=N1)NC(=S)NC(=O)COC2=CC=C(C=C2)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=N1)NC(=S)NC(=O)COC2=CC=C(C=C2)C)C

InChI

InChI=1S/C17H19N3O4S2/c1-4-23-15(22)14-11(3)26-17(19-14)20-16(25)18-13(21)9-24-12-7-5-10(2)6-8-12/h5-8H,4,9H2,1-3H3,(H2,18,19,20,21,25)