Vitas-M small molecule compound
2-amino-4-{4-[(2-chloro-4-fluorophenoxy)methyl]-5-methylthiophen-2-yl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Catalog ID
STL175654
SMILES N#Cc1c(N)nc2c(c1c1sc(c(c1)COc1ccc(cc1Cl)F)C)CCCC2
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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 C22H19ClFN3OS MW 427.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClFN3OS/c1-12-13(11-28-19-7-6-14(24)9-17(19)23)8-20(29-12)21-15-4-2-3-5-18(15)27-22(26)16(21)10-25/h6-9H,2-5,11H2,1H3,(H2,26,27)InChIKey
NDUWYESQGCICCE-UHFFFAOYSA-NSynonyms
438217-46-02amino4(4((2chloro4fluorophenoxy)methyl)5methylthiophen2yl)5678tetrahydroquinoline3carbonitrile
438217460
CC1=C(C=C(S1)C2=C(C(=NC3=C2CCCC3)N)C#N)COC4=C(C=C(C=C4)F)Cl
InChI=1SC22H19ClFN3OSc11213(1128197614(24)917(19)23)820(2912)2115423518(15)2722(26)16(21)1025h69H2511H21H3(H22627)
MFCD03312596
ZINC000019841577
ZINC19841577
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