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

Systemtic Name: ethyl 2-[(4-fluorophenyl)carbamothioylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(4-fluorophenyl)carbamothioylamino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[(4-fluoroanilino)-sulfanylidenemethyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-fluorophenyl)carbamothioylamino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(4-fluorophenyl)thiocarbamoylamino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C14H14FN3O2S2 MolecularWeight: 339.408263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=S)NC2=CC=C(C=C2)F)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=S)NC2=CC=C(C=C2)F)C

InChI

InChI=1S/C14H14FN3O2S2/c1-3-20-12(19)11-8(2)16-14(22-11)18-13(21)17-10-6-4-9(15)5-7-10/h4-7H,3H2,1-2H3,(H2,16,17,18,21)