1-(4-bromophenyl)sulfonyl-N-cyclopropyl-N-[(2-fluorophenyl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-(4-bromophenyl)sulfonyl-N-cyclopropyl-N-[(2-fluorophenyl)methyl]piperidine-3-carboxamide Openeye Name: 1-(4-bromophenyl)sulfonyl-N-cyclopropyl-N-[(2-fluorophenyl)methyl]piperidine-3-carboxamide CAS Name: 1-(4-bromophenyl)sulfonyl-N-cyclopropyl-N-[(2-fluorophenyl)methyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-bromophenyl)sulfonyl-N-cyclopropyl-N-[(2-fluorophenyl)methyl]piperidine-3-carboxamide Traditional Name: 1-brosyl-N-cyclopropyl-N-(2-fluorobenzyl)nipecotamide Formula: C22H24BrFN2O3S MolecularWeight: 495.404963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)N(CC3=CC=CC=C3F)C4CC4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)N(CC3=CC=CC=C3F)C4CC4

InChI

InChI=1S/C22H24BrFN2O3S/c23-18-7-11-20(12-8-18)30(28,29)25-13-3-5-17(14-25)22(27)26(19-9-10-19)15-16-4-1-2-6-21(16)24/h1-2,4,6-8,11-12,17,19H,3,5,9-10,13-15H2