Vitas-M small molecule compound
1-[4-(3-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]azepane
Catalog ID
STL180997
SMILES COc1cccc(c1)c1nc(nc(c1)C(F)(F)F)N1CCCCCC1
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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 C18H20F3N3O MW 351.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20F3N3O/c1-25-14-8-6-7-13(11-14)15-12-16(18(19,20)21)23-17(22-15)24-9-4-2-3-5-10-24/h6-8,11-12H,2-5,9-10H2,1H3InChIKey
NBIFIIZWHDFYRR-UHFFFAOYSA-NSynonyms
725695-42-11(4(3methoxyphenyl)6(trifluoromethyl)pyrimidin2yl)azepane
725695421
COC1=CC=CC(=C1)C2=CC(=NC(=N2)N3CCCCCC3)C(F)(F)F
InChI=1SC18H20F3N3Oc1251486713(1114)151216(18(1920)21)2317(2215)24942351024h681112H25910H21H3
MFCD06164322
ZINC000036618575
ZINC36618575
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