Vitas-M small molecule compound
2-(4-chloro-3-methylphenoxy)-N-[4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl]acetamide
Catalog ID
STK519430
SMILES O=C(COc1ccc(c(c1)C)Cl)NCc1ccc(cc1)c1nn2c(s1)nnc2C
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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 C20H18ClN5O2S MW 427.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN5O2S/c1-12-9-16(7-8-17(12)21)28-11-18(27)22-10-14-3-5-15(6-4-14)19-25-26-13(2)23-24-20(26)29-19/h3-9H,10-11H2,1-2H3,(H,22,27)InChIKey
PYEMCMNDLXRIBH-UHFFFAOYSA-NSynonyms
2(4chloro3methylphenoxy)N((4(3methyl(124)triazolo(34b)(134)thiadiazol6yl)phenyl)methyl)acetamide
2(4chloro3methylphenoxy)N(4(3methyl(124)triazolo(34b)(134)thiadiazol6yl)benzyl)acetamide
CC1=C(C=CC(=C1)OCC(=O)NCC2=CC=C(C=C2)C3=NN4C(=NN=C4S3)C)Cl
InChI=1SC20H18ClN5O2Sc112916(7817(12)21)281118(27)2210143515(6414)19252613(2)232420(26)2919h39H1011H212H3(H2227)
MFCD12130031
ZINC000020352453
ZINC20352453
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