N-[2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl]-1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-[2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl]-1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxamide Openeye Name: N-[2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl]-1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxamide CAS Name: N-[2-[4-(2-fluorophenyl)-1-piperazinyl]ethyl]-1-(1H-imidazol-5-ylsulfonyl)-3-piperidinecarboxamide IUPAC Name: N-[2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl]-1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxamide Traditional Name: N-[2-[4-(2-fluorophenyl)piperazino]ethyl]-1-(1H-imidazol-5-ylsulfonyl)nipecotamide Formula: C21H29FN6O3S MolecularWeight: 464.556763

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CN=CN2)C(=O)NCCN3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CN=CN2)C(=O)NCCN3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C21H29FN6O3S/c22-18-5-1-2-6-19(18)27-12-10-26(11-13-27)9-7-24-21(29)17-4-3-8-28(15-17)32(30,31)20-14-23-16-25-20/h1-2,5-6,14,16-17H,3-4,7-13,15H2,(H,23,25)(H,24,29)