ethyl 4-[2-(2-phenacylsulfanyl-1,3-thiazol-4-yl)ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(2-phenacylsulfanyl-1,3-thiazol-4-yl)ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(2-phenacylsulfanylthiazol-4-yl)acetyl]piperazine-1-carboxylate CAS Name: 4-[1-oxo-2-[2-(phenacylthio)-4-thiazolyl]ethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(2-phenacylsulfanyl-1,3-thiazol-4-yl)acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[2-(phenacylthio)thiazol-4-yl]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H23N3O4S2 MolecularWeight: 433.54432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CC2=CSC(=N2)SCC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CC2=CSC(=N2)SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H23N3O4S2/c1-2-27-20(26)23-10-8-22(9-11-23)18(25)12-16-13-28-19(21-16)29-14-17(24)15-6-4-3-5-7-15/h3-7,13H,2,8-12,14H2,1H3