Vitas-M small molecule compound
methyl 2-{[7-(4-chlorophenyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}propanoate
Catalog ID
STL053027
SMILES COC(=O)C(Sc1nnc2n1cnc1c2cnn1c1ccc(cc1)Cl)C
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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 C16H13ClN6O2S MW 388.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClN6O2S/c1-9(15(24)25-2)26-16-21-20-14-12-7-19-23(13(12)18-8-22(14)16)11-5-3-10(17)4-6-11/h3-9H,1-2H3InChIKey
SLGGMIYIINSPNE-UHFFFAOYSA-NSynonyms
844650-26-6844650266
CC(C(=O)OC)SC1=NN=C2N1C=NC3=C2C=NN3C4=CC=C(C=C4)Cl
InChI=1SC16H13ClN6O2Sc19(15(24)252)26162120141271923(13(12)18822(14)16)115310(17)4611h39H12H3
methyl2((7(4chlorophenyl)7Hpyrazolo(43e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)propanoate
methyl2((7(4chlorophenyl)7Hpyrazolo(43e)(124)triazolo(43c)pyrimidin3yl)thio)propanoate
MFCD04159018
ZINC000005151340
ZINC000005151344
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