Vitas-M small molecule compound
(6E)-6-{[1-(3,5-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-imino-2-(methylsulfanyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224656
SMILES CSc1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)c3cc(Cl)cc(c3)Cl)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 C19H15Cl2N5OS2 MW 464.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15Cl2N5OS2/c1-9-4-11(10(2)25(9)14-7-12(20)6-13(21)8-14)5-15-16(22)26-18(23-17(15)27)29-19(24-26)28-3/h4-8,22H,1-3H3/b15-5+,22-16-InChIKey
QSPDQQGKFJAHQB-DFTUYQMXSA-NSynonyms
843672-97-9(6E)6((1(35dichlorophenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino2(methylsulfanyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(35dichlorophenyl)25dimethyl1Hpyrrol3yl)methylene)5imino2(methylthio)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
843672979
CSc1nn2c(=NC(=O)C(=Cc3cc(n(c3C)c3cc(Cl)cc(c3)Cl)C)C2=N)s1
MFCD04163478
ZINC000009282567
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