Vitas-M small molecule compound
(6E)-6-{[1-(3-chloro-4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-imino-2-[2-(morpholin-4-yl)-2-oxoethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL247733
SMILES O=C(N1CCOCC1)Cc1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)c3ccc(c(c3)Cl)F)C)/C2=N)s1
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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 C24H22ClFN6O3S MW 528.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22ClFN6O3S/c1-13-9-15(14(2)31(13)16-3-4-19(26)18(25)11-16)10-17-22(27)32-24(28-23(17)34)36-20(29-32)12-21(33)30-5-7-35-8-6-30/h3-4,9-11,27H,5-8,12H2,1-2H3/b17-10+,27-22-InChIKey
LPFYMSFVIKBMSV-AURUSYKESA-NSynonyms
877786-86-2(6E)6((1(3chloro4fluorophenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino2(2(morpholin4yl)2oxoethyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(3chloro4fluorophenyl)25dimethyl1Hpyrrol3yl)methylene)5imino2(2morpholino2oxoethyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
877786862
MFCD05701424
O=C(N1CCOCC1)Cc1nn2c(=NC(=O)C(=Cc3cc(n(c3C)c3ccc(c(c3)Cl)F)C)C2=N)s1
ZINC000101245171
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