Vitas-M small molecule compound
(5E)-5-{[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]methylidene}-1-(3-fluorophenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STK850273
SMILES Fc1cccc(c1)N1C(=NC(=O)/C(=C\c2cc(n(c2C)c2cccnc2)C)/C1=O)S
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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 C22H17FN4O2S MW 420.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17FN4O2S/c1-13-9-15(14(2)26(13)18-7-4-8-24-12-18)10-19-20(28)25-22(30)27(21(19)29)17-6-3-5-16(23)11-17/h3-12H,1-2H3,(H,25,28,30)/b19-10+InChIKey
WISOJRVDPMKGJR-VXLYETTFSA-NSynonyms
444552-36-7(5E)5((25dimethyl1(pyridin3yl)1Hpyrrol3yl)methylidene)1(3fluorophenyl)2sulfanylpyrimidine46(1H5H)dione
(5E)5((25DIMETHYL1PYRIDIN3YLPYRROL3YL)METHYLIDENE)1(3FLUOROPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
444552367
CC1=CC(=C(N1C2=CN=CC=C2)C)C=C3C(=O)NC(=S)N(C3=O)C4=CC(=CC=C4)F
Fc1cccc(c1)N1C(=NC(=O)C(=Cc2cc(n(c2C)c2cccnc2)C)C1=O)S
InChI=1SC22H17FN4O2Sc113915(14(2)26(13)18748241218)101920(28)2522(30)27(21(19)29)1763516(23)1117h312H12H3(H252830)b1910+
MFCD07198072
ZINC000009009814
ZINC9009814
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