Vitas-M small molecule compound
1-butyl-5-(difluoromethyl)-7-(4-fluorophenyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STL179810
SMILES CCCCn1c(S)nc(=O)c2c1nc(cc2C(F)F)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 C18H16F3N3OS MW 379.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16F3N3OS/c1-2-3-8-24-16-14(17(25)23-18(24)26)12(15(20)21)9-13(22-16)10-4-6-11(19)7-5-10/h4-7,9,15H,2-3,8H2,1H3,(H,23,25,26)InChIKey
AVLKDHFQCXXCBL-UHFFFAOYSA-NSynonyms
1011394-70-91011394709
1butyl5(difluoromethyl)7(4fluorophenyl)2sulfanylidenepyrido(23d)pyrimidin4one
1butyl5(difluoromethyl)7(4fluorophenyl)2sulfanylpyrido(23d)pyrimidin4(1H)one
CCCCN1C2=C(C(=CC(=N2)C3=CC=C(C=C3)F)C(F)F)C(=O)NC1=S
InChI=1SC18H16F3N3OSc1238241614(17(25)2318(24)26)12(15(20)21)913(2216)104611(19)7510h47915H238H21H3(H232526)
MFCD09473301
ZINC000036617293
ZINC36617293
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