Vitas-M small molecule compound

5-[(2-chloro-4-fluorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK443195
SMILES C=CCn1c(COc2ccc(cc2Cl)F)nnc1S

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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 C12H11ClFN3OS MW 299.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11ClFN3OS/c1-2-5-17-11(15-16-12(17)19)7-18-10-4-3-8(14)6-9(10)13/h2-4,6H,1,5,7H2,(H,16,19)
InChIKey
RWWUTQVRGTXYJN-UHFFFAOYSA-N
Synonyms
667414-13-3
3((2CHLORO4FLUOROPHENOXY)METHYL)4PROP2ENYL1H124TRIAZOLE5THIONE
4ALLYL5((2CHLORO4FLUOROPHENOXY)METHYL)4H124TRIAZOLE3THIOL
5((2chloro4fluorophenoxy)methyl)4(prop2en1yl)4H124triazole3thiol
5((2CHLORO4FLUOROPHENOXY)METHYL)4PROP2ENYL124TRIAZOLE3THIOL
5(2CHLORO4FLUOROPHENOXYMETHYL)4(PROP2EN1YL)124TRIAZOLE3THIOL
667414133
C=CCN1C(=NNC1=S)COC2=C(C=C(C=C2)F)Cl
InChI=1SC12H11ClFN3OSc1251711(151612(17)19)71810438(14)69(10)13h246H157H2(H1619)
MFCD04054696
ZINC000002526652
ZINC02526652
ZINC2526652

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Available files

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