Vitas-M small molecule compound
3-chloro-4-ethoxy-N-[2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]benzamide
Catalog ID
STK336991
SMILES CCOc1ccc(cc1Cl)C(=O)Nc1cc(ccc1C)c1sc2n(n1)c(nn2)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 C20H18ClN5O2S MW 427.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN5O2S/c1-4-28-17-8-7-13(9-15(17)21)18(27)22-16-10-14(6-5-11(16)2)19-25-26-12(3)23-24-20(26)29-19/h5-10H,4H2,1-3H3,(H,22,27)InChIKey
RKPATFUGRUHKFP-UHFFFAOYSA-NSynonyms
3chloro4ethoxyN(2methyl5(3methyl(124)triazolo(34b)(134)thiadiazol6yl)phenyl)benzamide
CCOC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C3=NN4C(=NN=C4S3)C)C)Cl
InChI=1SC20H18ClN5O2Sc1428178713(915(17)21)18(27)22161014(6511(16)2)19252612(3)232420(26)2919h510H4H213H3(H2227)
MFCD04387399
ZINC000012843252
ZINC12843252
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