Vitas-M small molecule compound

2-({4-amino-5-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(4-methylphenyl)ethanone

Catalog ID
STK589088
SMILES Cc1ccc(cc1)C(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)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 C20H17FN6OS MW 408.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17FN6OS/c1-12-2-4-14(5-3-12)18(28)11-29-20-26-25-19(27(20)22)17-10-16(23-24-17)13-6-8-15(21)9-7-13/h2-10H,11,22H2,1H3,(H,23,24)
InChIKey
ZDZZGHBRBQTBSY-UHFFFAOYSA-N
Synonyms
879458-14-7
2((4AMINO5(3(4FLUOROPHENYL)1HPYRAZOL5YL)124TRIAZOL3YL)SULFANYL)1(4METHYLPHENYL)ETHANONE
2((4amino5(3(4fluorophenyl)1Hpyrazol5yl)4H124triazol3yl)thio)1(ptolyl)ethanone
2((4amino5(5(4fluorophenyl)1Hpyrazol3yl)4H124triazol3yl)sulfanyl)1(4methylphenyl)ethanone
2(4AMINO5(3(4FLUOROPHENYL)PYRAZOL5YL)(124TRIAZOL3YLTHIO))1(4METHYLPHENYL)ETHAN1ONE
879458147
CC1=CC=C(C=C1)C(=O)CSC2=NN=C(N2N)C3=CC(=NN3)C4=CC=C(C=C4)F
Cc1ccc(cc1)C(=O)CSc1nnc(n1N)c1(nH)nc(c1)c1ccc(cc1)F
Cc1ccc(cc1)C(=O)CSc1nnc(n1N)c1n(nH)c(c1)c1ccc(cc1)F
InChI=1SC20H17FN6OSc1122414(5312)18(28)112920262519(27(20)22)171016(232417)136815(21)9713h210H1122H21H3(H2324)
MFCD07208204
ZINC000009012628
ZINC09012628
ZINC9012628

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Available files

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