ethyl 4-[2-[3-(phenylmethyl)sulfonylpropanoylamino]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[3-(phenylmethyl)sulfonylpropanoylamino]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-(3-benzylsulfonylpropanoylamino)benzoyl]piperazine-1-carboxylate CAS Name: 4-[oxo-[2-[[1-oxo-3-(phenylmethyl)sulfonylpropyl]amino]phenyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(3-benzylsulfonylpropanoylamino)benzoyl]piperazine-1-carboxylate Traditional Name: 4-[2-(3-benzylsulfonylpropanoylamino)benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C24H29N3O6S MolecularWeight: 487.56856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)CCS(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)CCS(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C24H29N3O6S/c1-2-33-24(30)27-15-13-26(14-16-27)23(29)20-10-6-7-11-21(20)25-22(28)12-17-34(31,32)18-19-8-4-3-5-9-19/h3-11H,2,12-18H2,1H3,(H,25,28)