Vitas-M small molecule compound
2-chloro-4-{(Z)-[5-imino-7-oxo-2-(pyridin-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}phenyl benzoate
Catalog ID
STL239899
SMILES O=C(c1ccccc1)Oc1ccc(cc1Cl)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)c1cccnc1
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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 C24H14ClN5O3S MW 487.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H14ClN5O3S/c25-18-12-14(8-9-19(18)33-23(32)15-5-2-1-3-6-15)11-17-20(26)30-24(28-21(17)31)34-22(29-30)16-7-4-10-27-13-16/h1-13,26H/b17-11-,26-20-InChIKey
WEBXRIWISHHBQC-WCLUFEFRSA-NSynonyms
846065-72-3(Z)2chloro4((5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenylbenzoate
2chloro4((Z)(5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenylbenzoate
846065723
MFCD04174096
O=C(c1ccccc1)Oc1ccc(cc1Cl)C=C1C(=O)N=c2n(C1=N)nc(s2)c1cccnc1
ZINC000009304192
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