ethyl 2-[2-(thiophen-2-ylcarbonylcarbamothioylamino)-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-(thiophen-2-ylcarbonylcarbamothioylamino)-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-(thiophene-2-carbonylcarbamothioylamino)thiazol-4-yl]acetate CAS Name: 2-[2-[[[[oxo(thiophen-2-yl)methyl]amino]-sulfanylidenemethyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(thiophene-2-carbonylcarbamothioylamino)-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-(2-thenoylthiocarbamoylamino)thiazol-4-yl]acetic acid ethyl ester Formula: C13H13N3O3S3 MolecularWeight: 355.45562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=S)NC(=O)C2=CC=CS2

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=S)NC(=O)C2=CC=CS2

InChI

InChI=1S/C13H13N3O3S3/c1-2-19-10(17)6-8-7-22-13(14-8)16-12(20)15-11(18)9-4-3-5-21-9/h3-5,7H,2,6H2,1H3,(H2,14,15,16,18,20)