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}-6-methoxyphenyl benzoate
Catalog ID
STL238119
SMILES COc1cc(cc(c1OC(=O)c1ccccc1)Cl)/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 C25H16ClN5O4S MW 517.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H16ClN5O4S/c1-34-19-12-14(11-18(26)20(19)35-24(33)15-6-3-2-4-7-15)10-17-21(27)31-25(29-22(17)32)36-23(30-31)16-8-5-9-28-13-16/h2-13,27H,1H3/b17-10-,27-21-InChIKey
XXYRHXQAEMOVJA-UIKAJGNISA-NSynonyms
847854-83-5(Z)2chloro4((5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)6methoxyphenylbenzoate
2chloro4((Z)(5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)6methoxyphenylbenzoate
847854835
COc1cc(cc(c1OC(=O)c1ccccc1)Cl)C=C1C(=O)N=c2n(C1=N)nc(s2)c1cccnc1
MFCD04185108
ZINC000101150593
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