Vitas-M small molecule compound

3-(difluoromethyl)-5-(ethylsulfanyl)-N-{(E)-[5-(phenoxymethyl)furan-2-yl]methylidene}-4H-1,2,4-triazol-4-amine

Catalog ID
STL173532
SMILES CCSc1nnc(n1/N=C/c1ccc(o1)COc1ccccc1)C(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 C17H16F2N4O2S MW 378.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16F2N4O2S/c1-2-26-17-22-21-16(15(18)19)23(17)20-10-13-8-9-14(25-13)11-24-12-6-4-3-5-7-12/h3-10,15H,2,11H2,1H3/b20-10+
InChIKey
ZUHFGIOIDFLZCO-KEBDBYFISA-N
Synonyms
866737-27-1
(E)N(3(difluoromethyl)5ethylsulfanyl124triazol4yl)1(5(phenoxymethyl)furan2yl)methanimine
3(difluoromethyl)5(ethylsulfanyl)N((E)(5(phenoxymethyl)furan2yl)methylidene)4H124triazol4amine
866737271
CCSC1=NN=C(N1N=CC2=CC=C(O2)COC3=CC=CC=C3)C(F)F
CCSc1nnc(n1N=Cc1ccc(o1)COc1ccccc1)C(F)F
InChI=1SC17H16F2N4O2Sc122617222116(15(18)19)23(17)2010138914(2513)1124126435712h31015H211H21H3b2010+
MFCD08553323
ZINC000036611370
ZINC96569498

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Available files

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