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

Systemtic Name: ethyl 4-[2-[(2-propan-2-ylsulfanylphenyl)carbonylamino]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(2-isopropylsulfanylbenzoyl)amino]benzoyl]piperazine-1-carboxylate CAS Name: 4-[oxo-[2-[[oxo-[2-(propan-2-ylthio)phenyl]methyl]amino]phenyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(2-propan-2-ylsulfanylbenzoyl)amino]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[2-[[2-(isopropylthio)benzoyl]amino]benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C24H29N3O4S MolecularWeight: 455.56976

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=CC=CC=C3SC(C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=CC=CC=C3SC(C)C

InChI

InChI=1S/C24H29N3O4S/c1-4-31-24(30)27-15-13-26(14-16-27)23(29)18-9-5-7-11-20(18)25-22(28)19-10-6-8-12-21(19)32-17(2)3/h5-12,17H,4,13-16H2,1-3H3,(H,25,28)