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

Systemtic Name: 3-[2,6-bis(fluoranyl)phenyl]-4-(pyrrolidin-1-ium-1-ylmethyl)-1,3-thiazole-2-thione Openeye Name: 3-(2,6-difluorophenyl)-4-(pyrrolidin-1-ium-1-ylmethyl)thiazole-2-thione CAS Name: 3-(2,6-difluorophenyl)-4-(1-pyrrolidin-1-iumylmethyl)-2-thiazolethione IUPAC Name: 3-(2,6-difluorophenyl)-4-(pyrrolidin-1-ium-1-ylmethyl)-1,3-thiazole-2-thione Traditional Name: 3-(2,6-difluorophenyl)-4-(pyrrolidin-1-ium-1-ylmethyl)-4-thiazoline-2-thione Formula: C14H15F2N2S2+ MolecularWeight: 313.409106

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CSC(=S)N2C3=C(C=CC=C3F)F

Isomeric SMILES

C1CC[NH+](C1)CC2=CSC(=S)N2C3=C(C=CC=C3F)F

InChI

InChI=1S/C14H14F2N2S2/c15-11-4-3-5-12(16)13(11)18-10(9-20-14(18)19)8-17-6-1-2-7-17/h3-5,9H,1-2,6-8H2/p+1