N-(1,3-benzodioxol-5-ylmethyl)-4-[bis(fluoranyl)methylsulfanyl]-N-cyclopentyl-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[bis(fluoranyl)methylsulfanyl]-N-cyclopentyl-benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-4-(difluoromethylsulfanyl)benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-4-(difluoromethylthio)benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-4-(difluoromethylsulfanyl)benzamide Traditional Name: N-cyclopentyl-4-(difluoromethylthio)-N-piperonyl-benzamide Formula: C21H21F2NO3S MolecularWeight: 405.458146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(C=C4)SC(F)F

Isomeric SMILES

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(C=C4)SC(F)F

InChI

InChI=1S/C21H21F2NO3S/c22-21(23)28-17-8-6-15(7-9-17)20(25)24(16-3-1-2-4-16)12-14-5-10-18-19(11-14)27-13-26-18/h5-11,16,21H,1-4,12-13H2