ethyl 4-[2-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]benzoyl]piperazine-1-carboxylate CAS Name: 4-[oxo-[2-[[oxo-[3-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]phenyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(3-pyrrolidinosulfonylbenzoyl)amino]benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C25H30N4O6S MolecularWeight: 514.5939

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C25H30N4O6S/c1-2-35-25(32)28-16-14-27(15-17-28)24(31)21-10-3-4-11-22(21)26-23(30)19-8-7-9-20(18-19)36(33,34)29-12-5-6-13-29/h3-4,7-11,18H,2,5-6,12-17H2,1H3,(H,26,30)