Vitas-M small molecule compound

7-(4-tert-butylphenyl)-1-cyclopropyl-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one

Catalog ID
STL179267
SMILES O=c1nc(S)n(c2c1c(cc(n2)c1ccc(cc1)C(C)(C)C)C(F)(F)F)C1CC1

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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 C21H20F3N3OS MW 419.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20F3N3OS/c1-20(2,3)12-6-4-11(5-7-12)15-10-14(21(22,23)24)16-17(25-15)27(13-8-9-13)19(29)26-18(16)28/h4-7,10,13H,8-9H2,1-3H3,(H,26,28,29)
InChIKey
JBFLSAXYHPKKPG-UHFFFAOYSA-N
Synonyms

7(4tertbutylphenyl)1cyclopropyl2sulfanyl5(trifluoromethyl)pyrido(23d)pyrimidin4(1H)one
7(4tertbutylphenyl)1cyclopropyl2sulfanylidene5(trifluoromethyl)pyrido(23d)pyrimidin4one
CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C(=C2)C(F)(F)F)C(=O)NC(=S)N3C4CC4
InChI=1SC21H20F3N3OSc120(23)126411(5712)151014(21(2223)24)1617(2515)27(138913)19(29)2618(16)28h471013H89H213H3(H262829)
MFCD09472660
ZINC000020603759
ZINC20603759

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Available files

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