N-[(4-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(4-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(4-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[(4-fluorophenyl)-(1-methyl-2-imidazolyl)methyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(4-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[(4-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C21H23FN4O3S2 MolecularWeight: 462.560723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=C(C=C2)F)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CN1C=CN=C1C(C2=CC=C(C=C2)F)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H23FN4O3S2/c1-25-13-10-23-20(25)19(15-4-6-17(22)7-5-15)24-21(27)16-8-11-26(12-9-16)31(28,29)18-3-2-14-30-18/h2-7,10,13-14,16,19H,8-9,11-12H2,1H3,(H,24,27)