Vitas-M small molecule compound
(6E)-6-({2,5-dimethyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl}methylidene)-5-imino-2-(pyridin-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL241672
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C\c1cc(n(c1C)c1cccc(c1)C(F)(F)F)C)c1cccnc1
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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 C24H17F3N6OS MW 494.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17F3N6OS/c1-13-9-16(14(2)32(13)18-7-3-6-17(11-18)24(25,26)27)10-19-20(28)33-23(30-21(19)34)35-22(31-33)15-5-4-8-29-12-15/h3-12,28H,1-2H3/b19-10+,28-20-InChIKey
DVYUTVOGTUTNDC-UFDRZWQESA-NSynonyms
847376-90-3(6E)6((25dimethyl1(3(trifluoromethyl)phenyl)1Hpyrrol3yl)methylidene)5imino2(pyridin3yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((25dimethyl1(3(trifluoromethyl)phenyl)1Hpyrrol3yl)methylene)5imino2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
847376903
MFCD04181237
O=C1N=c2sc(nn2C(=N)C1=Cc1cc(n(c1C)c1cccc(c1)C(F)(F)F)C)c1cccnc1
ZINC000009158995
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