Vitas-M small molecule compound

(6Z)-6-{[1-(3-chloro-4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-imino-2-(2-methylphenyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Catalog ID
STL224903
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C/c1cc(n(c1C)c1ccc(c(c1)Cl)F)C)c1ccccc1C

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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 C25H19ClFN5OS MW 491.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19ClFN5OS/c1-13-6-4-5-7-18(13)24-30-32-22(28)19(23(33)29-25(32)34-24)11-16-10-14(2)31(15(16)3)17-8-9-21(27)20(26)12-17/h4-12,28H,1-3H3/b19-11-,28-22-
InChIKey
VKADLJXSOZXIRV-FCJRWJNUSA-N
Synonyms

(6Z)6((1(3chloro4fluorophenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino2(2methylphenyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(3chloro4fluorophenyl)25dimethyl1Hpyrrol3yl)methylene)5imino2(otolyl)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
MFCD24857947
O=C1N=c2sc(nn2C(=N)C1=Cc1cc(n(c1C)c1ccc(c(c1)Cl)F)C)c1ccccc1C
ZINC000002390199

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Available files

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