Vitas-M small molecule compound
methyl {[5-(3-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Catalog ID
STK481539
SMILES COC(=O)CSc1nnc(n1C)c1cccc(c1)Cl
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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 C12H12ClN3O2S MW 297.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12ClN3O2S/c1-16-11(8-4-3-5-9(13)6-8)14-15-12(16)19-7-10(17)18-2/h3-6H,7H2,1-2H3InChIKey
NGDIORSBQZQYTC-UHFFFAOYSA-NSynonyms
CN1C(=NN=C1SCC(=O)OC)C2=CC(=CC=C2)Cl
InChI=1SC12H12ClN3O2Sc11611(84359(13)68)141512(16)19710(17)182h36H7H212H3
methyl((5(3chlorophenyl)4methyl4H124triazol3yl)sulfanyl)acetate
METHYL2((5(3CHLOROPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETATE
METHYL2(5(3CHLOROPHENYL)4METHYL124TRIAZOL3YLTHIO)ACETATE
MFCD04036253
ZINC000002523584
ZINC02523584
ZINC2523584
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