ethyl 4-[2-[2-oxidanylidene-2-[(4-thiophen-2-yl-1,3-thiazol-2-yl)amino]ethyl]sulfanylethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[2-oxidanylidene-2-[(4-thiophen-2-yl-1,3-thiazol-2-yl)amino]ethyl]sulfanylethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[2-oxo-2-[[4-(2-thienyl)thiazol-2-yl]amino]ethyl]sulfanylacetyl]piperazine-1-carboxylate CAS Name: 4-[1-oxo-2-[[2-oxo-2-[(4-thiophen-2-yl-2-thiazolyl)amino]ethyl]thio]ethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[2-oxo-2-[(4-thiophen-2-yl-1,3-thiazol-2-yl)amino]ethyl]sulfanylacetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[[2-keto-2-[[4-(2-thienyl)thiazol-2-yl]amino]ethyl]thio]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H22N4O4S3 MolecularWeight: 454.58668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CSCC(=O)NC2=NC(=CS2)C3=CC=CS3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CSCC(=O)NC2=NC(=CS2)C3=CC=CS3

InChI

InChI=1S/C18H22N4O4S3/c1-2-26-18(25)22-7-5-21(6-8-22)16(24)12-27-11-15(23)20-17-19-13(10-29-17)14-4-3-9-28-14/h3-4,9-10H,2,5-8,11-12H2,1H3,(H,19,20,23)