Vitas-M small molecule compound
3-{[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}-9-(3,4-dimethylphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazine
Catalog ID
STL126186
SMILES Cc1cc(ccc1C)c1nn2c(c1)c1nnc(n1cc2)SCc1c(C)noc1C
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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 C21H20N6OS MW 404.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6OS/c1-12-5-6-16(9-13(12)2)18-10-19-20-22-23-21(26(20)7-8-27(19)24-18)29-11-17-14(3)25-28-15(17)4/h5-10H,11H2,1-4H3InChIKey
LRDQIYNACCUQRL-UHFFFAOYSA-NSynonyms
3(((35dimethyl12oxazol4yl)methyl)sulfanyl)9(34dimethylphenyl)pyrazolo(15a)(124)triazolo(34c)pyrazine
CC1=C(C=C(C=C1)C2=NN3C=CN4C(=NN=C4SCC5=C(ON=C5C)C)C3=C2)C
InChI=1SC21H20N6OSc1125616(913(12)2)18101920222321(26(20)7827(19)2418)29111714(3)252815(17)4h510H11H214H3
MFCD20738617
ZINC000067260645
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