[2-[(4-fluorophenyl)carbamothioylamino]-1,3-thiazol-4-yl] 2-oxidanylidenebutanoate

Systemtic Name: [2-[(4-fluorophenyl)carbamothioylamino]-1,3-thiazol-4-yl] 2-oxidanylidenebutanoate Openeye Name: [2-[(4-fluorophenyl)carbamothioylamino]thiazol-4-yl] 2-oxobutanoate CAS Name: 2-oxobutanoic acid [2-[[(4-fluoroanilino)-sulfanylidenemethyl]amino]-4-thiazolyl] ester IUPAC Name: [2-[(4-fluorophenyl)carbamothioylamino]-1,3-thiazol-4-yl] 2-oxobutanoate Traditional Name: 2-ketobutyric acid [2-[(4-fluorophenyl)thiocarbamoylamino]thiazol-4-yl] ester Formula: C14H12FN3O3S2 MolecularWeight: 353.391783

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(=O)OC1=CSC(=N1)NC(=S)NC2=CC=C(C=C2)F

Isomeric SMILES

CCC(=O)C(=O)OC1=CSC(=N1)NC(=S)NC2=CC=C(C=C2)F

InChI

InChI=1S/C14H12FN3O3S2/c1-2-10(19)12(20)21-11-7-23-14(17-11)18-13(22)16-9-5-3-8(15)4-6-9/h3-7H,2H2,1H3,(H2,16,17,18,22)