Vitas-M small molecule compound
5-(difluoromethyl)-7-(1,5-dimethyl-1H-pyrazol-4-yl)-1-(2-methoxyethyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STL394290
SMILES COCCn1c(S)nc(=O)c2c1nc(cc2C(F)F)c1cnn(c1C)C
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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 C16H17F2N5O2S MW 381.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17F2N5O2S/c1-8-10(7-19-22(8)2)11-6-9(13(17)18)12-14(20-11)23(4-5-25-3)16(26)21-15(12)24/h6-7,13H,4-5H2,1-3H3,(H,21,24,26)InChIKey
LBOOQMKGJLVJGI-UHFFFAOYSA-NSynonyms
1174845-68-11174845681
5(DIFLUOROMETHYL)7(15DIMETHYL1HPYRAZOL4YL)1(2METHOXYETHYL)2SULFANYLPYRIDO(23D)PYRIMIDIN4(1H)ONE
5(difluoromethyl)7(15dimethylpyrazol4yl)1(2methoxyethyl)2sulfanylidenepyrido(23d)pyrimidin4one
CC1=C(C=NN1C)C2=NC3=C(C(=C2)C(F)F)C(=O)NC(=S)N3CCOC
InChI=1SC16H17F2N5O2Sc1810(71922(8)2)1169(13(17)18)1214(2011)23(45253)16(26)2115(12)24h6713H45H213H3(H212426)
MFCD09473161
ZINC000020604567
ZINC20604567
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