Vitas-M small molecule compound
5-[(2-fluorobenzyl)sulfanyl]-3-[2-oxo-2-(thiophen-2-yl)ethyl]-1,3,4-thiadiazol-2(3H)-iminium
Catalog ID
STK084261
SMILES O=C(c1cccs1)Cn1nc(sc1=[NH2+])SCc1ccccc1F
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C15H13FN3OS3 MW 366.48 g/mol Purity >90% as per NMR
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+1InChIKey
HVWFCSKHWOSSQA-UHFFFAOYSA-OSynonyms
2(2AMINO5((2FLUOROPHENYL)METHYLSULFANYL)134THIADIAZOL3IUM3YL)1THIOPHEN2YLETHANONE
5((2FLUOROBENZYL)SULFANYL)3(2OXO2(THIOPHEN2YL)ETHYL)134THIADIAZOL2(3H)IMINIUM
C1=CC=C(C(=C1)CSC2=N(N+)(=C(S2)N)CC(=O)C3=CC=CS3)F
InChI=1SC15H12FN3OS3c1611521410(11)922151819(14(17)2315)812(20)136372113h1717H89H2p+1
O=C(c1cccs1)Cn1nc(sc1=(NH2+))SCc1ccccc1F
STK084261
ZINC000004672477
ZINC33761741
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