Vitas-M small molecule compound
1-(butan-2-yl)-7-(3,4-dichlorophenyl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STL179325
SMILES CCC(n1c(S)nc(=O)c2c1nc(cc2C(F)(F)F)c1ccc(c(c1)Cl)Cl)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 C18H14Cl2F3N3OS MW 448.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14Cl2F3N3OS/c1-3-8(2)26-15-14(16(27)25-17(26)28)10(18(21,22)23)7-13(24-15)9-4-5-11(19)12(20)6-9/h4-8H,3H2,1-2H3,(H,25,27,28)InChIKey
NNGXOBNYLCUBMY-UHFFFAOYSA-NSynonyms
1011394-06-11(butan2yl)7(34dichlorophenyl)2sulfanyl5(trifluoromethyl)pyrido(23d)pyrimidin4(1H)one
1011394061
1butan2yl7(34dichlorophenyl)2sulfanylidene5(trifluoromethyl)pyrido(23d)pyrimidin4one
CCC(C)N1C2=C(C(=CC(=N2)C3=CC(=C(C=C3)Cl)Cl)C(F)(F)F)C(=O)NC1=S
InChI=1SC18H14Cl2F3N3OSc138(2)261514(16(27)2517(26)28)10(18(2122)23)713(2415)94511(19)12(20)69h48H3H212H3(H252728)
MFCD09472519
ZINC000020615221
ZINC000020615223
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