4-(5-methylthiophen-2-yl)sulfonyl-N-[[4-(trifluoromethyloxy)phenyl]methyl]piperazine-1-carboxamide

Systemtic Name: 4-(5-methylthiophen-2-yl)sulfonyl-N-[[4-(trifluoromethyloxy)phenyl]methyl]piperazine-1-carboxamide Openeye Name: 4-[(5-methyl-2-thienyl)sulfonyl]-N-[[4-(trifluoromethoxy)phenyl]methyl]piperazine-1-carboxamide CAS Name: 4-[(5-methyl-2-thiophenyl)sulfonyl]-N-[[4-(trifluoromethoxy)phenyl]methyl]-1-piperazinecarboxamide IUPAC Name: 4-(5-methylthiophen-2-yl)sulfonyl-N-[[4-(trifluoromethoxy)phenyl]methyl]piperazine-1-carboxamide Traditional Name: 4-[(5-methyl-2-thienyl)sulfonyl]-N-[4-(trifluoromethoxy)benzyl]piperazine-1-carboxamide Formula: C18H20F3N3O4S2 MolecularWeight: 463.49431

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)NCC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)NCC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C18H20F3N3O4S2/c1-13-2-7-16(29-13)30(26,27)24-10-8-23(9-11-24)17(25)22-12-14-3-5-15(6-4-14)28-18(19,20)21/h2-7H,8-12H2,1H3,(H,22,25)