ethyl 4-[2-oxidanylidene-2-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-oxidanylidene-2-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-oxo-2-(4-pyrrolidin-1-ylsulfonylanilino)ethyl]piperazine-1-carboxylate CAS Name: 4-[2-oxo-2-[4-(1-pyrrolidinylsulfonyl)anilino]ethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-oxo-2-(4-pyrrolidin-1-ylsulfonylanilino)ethyl]piperazine-1-carboxylate Traditional Name: 4-[2-keto-2-(4-pyrrolidinosulfonylanilino)ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H28N4O5S MolecularWeight: 424.51442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H28N4O5S/c1-2-28-19(25)22-13-11-21(12-14-22)15-18(24)20-16-5-7-17(8-6-16)29(26,27)23-9-3-4-10-23/h5-8H,2-4,9-15H2,1H3,(H,20,24)