2-[2-azanyl-5-[(2-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-3-ium-3-yl]-1-thiophen-2-yl-ethanone

Systemtic Name: 2-[2-azanyl-5-[(2-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-3-ium-3-yl]-1-thiophen-2-yl-ethanone Openeye Name: 2-[2-amino-5-[(2-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-3-ium-3-yl]-1-(2-thienyl)ethanone CAS Name: 2-[2-amino-5-[(2-fluorophenyl)methylthio]-1,3,4-thiadiazol-3-ium-3-yl]-1-thiophen-2-ylethanone IUPAC Name: 2-[2-amino-5-[(2-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-3-ium-3-yl]-1-thiophen-2-ylethanone Traditional Name: 2-[2-amino-5-[(2-fluorobenzyl)thio]-1,3,4-thiadiazol-3-ium-3-yl]-1-(2-thienyl)ethanone Formula: C15H13FN3OS3+ MolecularWeight: 366.476623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=N[N+](=C(S2)N)CC(=O)C3=CC=CS3)F

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=N[N+](=C(S2)N)CC(=O)C3=CC=CS3)F

InChI

InChI=1S/C15H12FN3OS3/c16-11-5-2-1-4-10(11)9-22-15-18-19(14(17)23-15)8-12(20)13-6-3-7-21-13/h1-7,17H,8-9H2/p+1