Vitas-M small molecule compound
[5-(3-nitrophenyl)furan-2-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanethione
Catalog ID
STL056521
SMILES S=C(c1ccc(o1)c1cccc(c1)[N+](=O)[O-])N1CCN(CC1)c1cccc(c1)C(F)(F)F
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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 C22H18F3N3O3S MW 461.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18F3N3O3S/c23-22(24,25)16-4-2-5-17(14-16)26-9-11-27(12-10-26)21(32)20-8-7-19(31-20)15-3-1-6-18(13-15)28(29)30/h1-8,13-14H,9-12H2InChIKey
AMWULRNJUSBAKF-UHFFFAOYSA-NSynonyms
578698-46-1(5(3nitrophenyl)furan2yl)(4(3(trifluoromethyl)phenyl)piperazin1yl)methanethione
578698461
C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=S)C3=CC=C(O3)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC22H18F3N3O3Sc2322(2425)1642517(1416)2691127(121026)21(32)208719(3120)1531618(1315)28(29)30h181314H912H2
MFCD04029095
S=C(c1ccc(o1)c1cccc(c1)(N+)(=O)(O))N1CCN(CC1)c1cccc(c1)C(F)(F)F
ZINC000001315621
ZINC01315621
ZINC1315621
Check stock
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Check stock on Vitas-MAvailable files
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