ethyl 5-methyl-2-[(4-methylphenyl)carbonylcarbamothioylamino]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-2-[(4-methylphenyl)carbonylcarbamothioylamino]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 5-methyl-2-[(4-methylbenzoyl)carbamothioylamino]thiazole-4-carboxylate CAS Name: 5-methyl-2-[[[[(4-methylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-2-[(4-methylbenzoyl)carbamothioylamino]-1,3-thiazole-4-carboxylate Traditional Name: 5-methyl-2-(p-toluoylthiocarbamoylamino)thiazole-4-carboxylic acid ethyl ester Formula: C16H17N3O3S2 MolecularWeight: 363.45448

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O3S2/c1-4-22-14(21)12-10(3)24-16(17-12)19-15(23)18-13(20)11-7-5-9(2)6-8-11/h5-8H,4H2,1-3H3,(H2,17,18,19,20,23)