N-butyl-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-methylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-butyl-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-methylsulfonyl-piperidine-3-carboxamide Openeye Name: N-butyl-N-[4-(4-fluorophenyl)thiazol-2-yl]-1-methylsulfonyl-piperidine-3-carboxamide CAS Name: N-butyl-N-[4-(4-fluorophenyl)-2-thiazolyl]-1-methylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-butyl-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-1-methylsulfonylpiperidine-3-carboxamide Traditional Name: N-butyl-N-[4-(4-fluorophenyl)thiazol-2-yl]-1-mesyl-nipecotamide Formula: C20H26FN3O3S2 MolecularWeight: 439.567143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=NC(=CS1)C2=CC=C(C=C2)F)C(=O)C3CCCN(C3)S(=O)(=O)C

Isomeric SMILES

CCCCN(C1=NC(=CS1)C2=CC=C(C=C2)F)C(=O)C3CCCN(C3)S(=O)(=O)C

InChI

InChI=1S/C20H26FN3O3S2/c1-3-4-12-24(19(25)16-6-5-11-23(13-16)29(2,26)27)20-22-18(14-28-20)15-7-9-17(21)10-8-15/h7-10,14,16H,3-6,11-13H2,1-2H3