4-[2,4-bis(fluoranyl)phenyl]sulfonyl-N-propyl-piperazine-1-carbothioamide

Systemtic Name: 4-[2,4-bis(fluoranyl)phenyl]sulfonyl-N-propyl-piperazine-1-carbothioamide Openeye Name: 4-(2,4-difluorophenyl)sulfonyl-N-propyl-piperazine-1-carbothioamide CAS Name: 4-(2,4-difluorophenyl)sulfonyl-N-propyl-1-piperazinecarbothioamide IUPAC Name: 4-(2,4-difluorophenyl)sulfonyl-N-propylpiperazine-1-carbothioamide Traditional Name: 4-(2,4-difluorophenyl)sulfonyl-N-propyl-piperazine-1-carbothioamide Formula: C14H19F2N3O2S2 MolecularWeight: 363.446366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2)F)F

Isomeric SMILES

CCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2)F)F

InChI

InChI=1S/C14H19F2N3O2S2/c1-2-5-17-14(22)18-6-8-19(9-7-18)23(20,21)13-4-3-11(15)10-12(13)16/h3-4,10H,2,5-9H2,1H3,(H,17,22)