Vitas-M small molecule compound
[(4Z)-2-thioxo-4-{[3-(trifluoromethyl)phenyl]imino}-1,3-diazaspiro[4.5]dec-1-yl]acetonitrile
Catalog ID
STK751168
SMILES N#CCN1C(=S)N/C(=N\c2cccc(c2)C(F)(F)F)/C21CCCCC2
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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 C17H17F3N4S MW 366.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17F3N4S/c18-17(19,20)12-5-4-6-13(11-12)22-14-16(7-2-1-3-8-16)24(10-9-21)15(25)23-14/h4-6,11H,1-3,7-8,10H2,(H,22,23,25)InChIKey
WSTIUDFXYGWOHR-UHFFFAOYSA-NSynonyms
((4Z)2thioxo4((3(trifluoromethyl)phenyl)imino)13diazaspiro(45)dec1yl)acetonitrile
(2THIOXO4((3(TRIFLUOROMETHYL)PHENYL)AMINO)13DIAZASPIRO(45)DEC3EN1YL)ACETONITRILE
2(2sulfanylidene4(3(trifluoromethyl)anilino)13diazaspiro(45)dec3en1yl)acetonitrile
2(3SULFANYLIDENE1(3(TRIFLUOROMETHYL)ANILINO)24DIAZASPIRO(45)DEC1EN4YL)ACETONITRILE
C1CCC2(CC1)C(=NC(=S)N2CC#N)NC3=CC=CC(=C3)C(F)(F)F
InChI=1SC17H17F3N4Sc1817(1920)1254613(1112)221416(7213816)24(10921)15(25)2314h4611H137810H2(H222325)
MFCD00740316
N#CCN1C(=S)NC(=Nc2cccc(c2)C(F)(F)F)C21CCCCC2
ZINC000005552137
ZINC05552137
ZINC5552137
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