Vitas-M small molecule compound
ethyl ({4-ethyl-5-[(5-phenyl-2H-tetrazol-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Catalog ID
STK743711
SMILES CCOC(=O)CSc1nnc(n1CC)Cn1nnc(n1)c1ccccc1
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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 C16H19N7O2S MW 373.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N7O2S/c1-3-22-13(17-19-16(22)26-11-14(24)25-4-2)10-23-20-15(18-21-23)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3InChIKey
BDLLCYJJOCIFOB-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)OCC)CN2N=C(N=N2)C3=CC=CC=C3
ethyl((4ethyl5((5phenyl2Htetrazol2yl)methyl)4H124triazol3yl)sulfanyl)acetate
ETHYL((4ETHYL5((5PHENYL2HTETRAZOL2YL)METHYL)4H124TRIAZOL3YL)THIO)ACETATE
ETHYL2((4ETHYL5((5PHENYLTETRAZOL2YL)METHYL)124TRIAZOL3YL)SULFANYL)ACETATE
InChI=1SC16H19N7O2Sc132213(171916(22)261114(24)2542)10232015(182123)128657912h59H341011H212H3
MFCD05239080
ZINC000000818863
ZINC00818863
ZINC818863
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