(3S)-1-(4-fluorophenyl)-5-oxidanylidene-N-[2-(4-phenylpiperazin-1-yl)sulfonylethyl]pyrrolidine-3-carboxamide

Systemtic Name: (3S)-1-(4-fluorophenyl)-5-oxidanylidene-N-[2-(4-phenylpiperazin-1-yl)sulfonylethyl]pyrrolidine-3-carboxamide Openeye Name: (3S)-1-(4-fluorophenyl)-5-oxo-N-[2-(4-phenylpiperazin-1-yl)sulfonylethyl]pyrrolidine-3-carboxamide CAS Name: (3S)-1-(4-fluorophenyl)-5-oxo-N-[2-[(4-phenyl-1-piperazinyl)sulfonyl]ethyl]-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-(4-fluorophenyl)-5-oxo-N-[2-(4-phenylpiperazin-1-yl)sulfonylethyl]pyrrolidine-3-carboxamide Traditional Name: (3S)-1-(4-fluorophenyl)-5-keto-N-[2-(4-phenylpiperazino)sulfonylethyl]pyrrolidine-3-carboxamide Formula: C23H27FN4O4S MolecularWeight: 474.548283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)CCNC(=O)C3CC(=O)N(C3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)CCNC(=O)[C@H]3CC(=O)N(C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H27FN4O4S/c24-19-6-8-21(9-7-19)28-17-18(16-22(28)29)23(30)25-10-15-33(31,32)27-13-11-26(12-14-27)20-4-2-1-3-5-20/h1-9,18H,10-17H2,(H,25,30)/t18-/m0/s1