Vitas-M small molecule compound
(6Z)-6-(2-bromobenzylidene)-2-heptyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK385572
SMILES CCCCCCCc1nn2c(=NC(=O)/C(=C\c3ccccc3Br)/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 C19H21BrN4OS MW 433.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21BrN4OS/c1-2-3-4-5-6-11-16-23-24-17(21)14(18(25)22-19(24)26-16)12-13-9-7-8-10-15(13)20/h7-10,12,21H,2-6,11H2,1H3/b14-12-,21-17-InChIKey
IHUGNZYRDWKPHS-SKZCFEMMSA-NSynonyms
(6Z)6(2bromobenzylidene)2heptyl5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCCCCCCc1nn2c(=NC(=O)C(=Cc3ccccc3Br)C2=N)s1
MFCD02118085
ZINC000059222159
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