N-[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-benzamide

Systemtic Name: N-[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-benzamide Openeye Name: N-[2-(2-furyl)-2-(1-piperidyl)ethyl]-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-benzamide CAS Name: N-[2-(2-furanyl)-2-(1-piperidinyl)ethyl]-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]benzamide IUPAC Name: N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylbenzamide Traditional Name: N-[2-(2-furyl)-2-piperidino-ethyl]-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]benzamide Formula: C25H24F3N3O4S MolecularWeight: 519.53597

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(CNC(=O)C2=CC=CC=C2SC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])C4=CC=CO4

Isomeric SMILES

C1CCN(CC1)C(CNC(=O)C2=CC=CC=C2SC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])C4=CC=CO4

InChI

InChI=1S/C25H24F3N3O4S/c26-25(27,28)17-10-11-23(19(15-17)31(33)34)36-22-9-3-2-7-18(22)24(32)29-16-20(21-8-6-14-35-21)30-12-4-1-5-13-30/h2-3,6-11,14-15,20H,1,4-5,12-13,16H2,(H,29,32)