Vitas-M small molecule compound

7-[4-(difluoromethoxy)phenyl]-1-(prop-2-en-1-yl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one

Catalog ID
STL179502
SMILES C=CCn1c(S)nc(=O)c2c1nc(cc2C(F)(F)F)c1ccc(cc1)OC(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 C18H12F5N3O2S MW 429.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12F5N3O2S/c1-2-7-26-14-13(15(27)25-17(26)29)11(18(21,22)23)8-12(24-14)9-3-5-10(6-4-9)28-16(19)20/h2-6,8,16H,1,7H2,(H,25,27,29)
InChIKey
XQKAAHHAGVCQKW-UHFFFAOYSA-N
Synonyms

7(4(difluoromethoxy)phenyl)1(prop2en1yl)2sulfanyl5(trifluoromethyl)pyrido(23d)pyrimidin4(1H)one
7(4(difluoromethoxy)phenyl)1prop2enyl2sulfanylidene5(trifluoromethyl)pyrido(23d)pyrimidin4one
C=CCN1C2=C(C(=CC(=N2)C3=CC=C(C=C3)OC(F)F)C(F)(F)F)C(=O)NC1=S
InChI=1SC18H12F5N3O2Sc127261413(15(27)2517(26)29)11(18(2122)23)812(2414)93510(649)2816(19)20h26816H17H2(H252729)
MFCD09473326
ZINC000020615594
ZINC20615594

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Available files

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