ethyl 2-[(5-chloranyl-2-methyl-phenyl)carbamothioylamino]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[(5-chloranyl-2-methyl-phenyl)carbamothioylamino]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[(5-chloro-2-methyl-phenyl)carbamothioylamino]thiazole-4-carboxylate CAS Name: 2-[[(5-chloro-2-methylanilino)-sulfanylidenemethyl]amino]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(5-chloro-2-methylphenyl)carbamothioylamino]-1,3-thiazole-4-carboxylate Traditional Name: 2-[(5-chloro-2-methyl-phenyl)thiocarbamoylamino]thiazole-4-carboxylic acid ethyl ester Formula: C14H14ClN3O2S2 MolecularWeight: 355.86286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)NC(=S)NC2=C(C=CC(=C2)Cl)C

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)NC(=S)NC2=C(C=CC(=C2)Cl)C

InChI

InChI=1S/C14H14ClN3O2S2/c1-3-20-12(19)11-7-22-14(17-11)18-13(21)16-10-6-9(15)5-4-8(10)2/h4-7H,3H2,1-2H3,(H2,16,17,18,21)