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 4-methylbenzenesulfonate
Catalog ID
STK657912
SMILES Cc1ccc(cc1)S(=O)(=O)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 C24H16ClN5O4S2 MW 538.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H16ClN5O4S2/c1-14-4-7-17(8-5-14)36(32,33)34-20-9-6-15(12-19(20)25)11-18-21(26)30-24(28-22(18)31)35-23(29-30)16-3-2-10-27-13-16/h2-13,26H,1H3/b18-11-,26-21-InChIKey
CRQMIWKQKKZYCL-HMQCCPTKSA-NSynonyms
844462-11-9(Z)2chloro4((5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenyl4methylbenzenesulfonate
2chloro4((Z)(5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenyl4methylbenzenesulfonate
844462119
Cc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1Cl)C=C1C(=O)N=c2n(C1=N)nc(s2)c1cccnc1
MFCD04157694
ZINC000006144811
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