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 2-chlorobenzoate
Catalog ID
STL233801
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C/c1ccc(c(c1)Cl)OC(=O)c1ccccc1Cl)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 C24H13Cl2N5O3S MW 522.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H13Cl2N5O3S/c25-17-6-2-1-5-15(17)23(33)34-19-8-7-13(11-18(19)26)10-16-20(27)31-24(29-21(16)32)35-22(30-31)14-4-3-9-28-12-14/h1-12,27H/b16-10-,27-20-InChIKey
ISFBVPUGHMSDPB-TVJGUEOHSA-NSynonyms
848765-90-2(Z)2chloro4((5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenyl2chlorobenzoate
2chloro4((Z)(5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenyl2chlorobenzoate
848765902
MFCD04193027
O=C1N=c2sc(nn2C(=N)C1=Cc1ccc(c(c1)Cl)OC(=O)c1ccccc1Cl)c1cccnc1
ZINC000101164996
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