Vitas-M small molecule compound
(6E)-6-{[5-(2-chlorophenyl)furan-2-yl]methylidene}-2-heptyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK052577
SMILES CCCCCCCc1nn2c(=NC(=O)/C(=C/c3ccc(o3)c3ccccc3Cl)/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 C23H23ClN4O2S MW 454.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23ClN4O2S/c1-2-3-4-5-6-11-20-27-28-21(25)17(22(29)26-23(28)31-20)14-15-12-13-19(30-15)16-9-7-8-10-18(16)24/h7-10,12-14,25H,2-6,11H2,1H3/b17-14+,25-21-InChIKey
YWCWQAJXCMKCEG-WUBPCWEUSA-NSynonyms
(6E)6((5(2chlorophenyl)furan2yl)methylidene)2heptyl5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCCCCCCc1nn2c(=NC(=O)C(=Cc3ccc(o3)c3ccccc3Cl)C2=N)s1
MFCD03227392
STK052577
ZINC000097958697
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