3-[2,6-bis(fluoranyl)phenyl]-4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazole-2-thione

Systemtic Name: 3-[2,6-bis(fluoranyl)phenyl]-4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazole-2-thione Openeye Name: 3-(2,6-difluorophenyl)-4-(piperidin-1-ium-1-ylmethyl)thiazole-2-thione CAS Name: 3-(2,6-difluorophenyl)-4-(1-piperidin-1-iumylmethyl)-2-thiazolethione IUPAC Name: 3-(2,6-difluorophenyl)-4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazole-2-thione Traditional Name: 3-(2,6-difluorophenyl)-4-(piperidin-1-ium-1-ylmethyl)-4-thiazoline-2-thione Formula: C15H17F2N2S2+ MolecularWeight: 327.435686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CSC(=S)N2C3=C(C=CC=C3F)F

Isomeric SMILES

C1CC[NH+](CC1)CC2=CSC(=S)N2C3=C(C=CC=C3F)F

InChI

InChI=1S/C15H16F2N2S2/c16-12-5-4-6-13(17)14(12)19-11(10-21-15(19)20)9-18-7-2-1-3-8-18/h4-6,10H,1-3,7-9H2/p+1