ethyl 4-[4-(pyrrolidin-1-ylcarbonylamino)phenyl]sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-(pyrrolidin-1-ylcarbonylamino)phenyl]sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-(pyrrolidine-1-carbonylamino)phenyl]sulfonylpiperazine-1-carboxylate CAS Name: 4-[4-[[oxo(1-pyrrolidinyl)methyl]amino]phenyl]sulfonyl-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(pyrrolidine-1-carbonylamino)phenyl]sulfonylpiperazine-1-carboxylate Traditional Name: 4-[4-(pyrrolidine-1-carbonylamino)phenyl]sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C18H26N4O5S MolecularWeight: 410.48784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N4O5S/c1-2-27-18(24)21-11-13-22(14-12-21)28(25,26)16-7-5-15(6-8-16)19-17(23)20-9-3-4-10-20/h5-8H,2-4,9-14H2,1H3,(H,19,23)