ethyl 4-[2-[(2-ethylsulfanylphenyl)carbonylamino]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(2-ethylsulfanylphenyl)carbonylamino]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(2-ethylsulfanylbenzoyl)amino]benzoyl]piperazine-1-carboxylate CAS Name: 4-[[2-[[[2-(ethylthio)phenyl]-oxomethyl]amino]phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(2-ethylsulfanylbenzoyl)amino]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[2-[[2-(ethylthio)benzoyl]amino]benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=CC=CC=C3SCC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=CC=CC=C3SCC

InChI

InChI=1S/C23H27N3O4S/c1-3-30-23(29)26-15-13-25(14-16-26)22(28)17-9-5-7-11-19(17)24-21(27)18-10-6-8-12-20(18)31-4-2/h5-12H,3-4,13-16H2,1-2H3,(H,24,27)