Vitas-M small molecule compound
4-tert-butyl-N-[5-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methoxyphenyl]benzamide
Catalog ID
STK345191
SMILES COc1ccc(cc1NC(=O)c1ccc(cc1)C(C)(C)C)c1nn2c(s1)nnc2CC
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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 C23H25N5O2S MW 435.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5O2S/c1-6-19-25-26-22-28(19)27-21(31-22)15-9-12-18(30-5)17(13-15)24-20(29)14-7-10-16(11-8-14)23(2,3)4/h7-13H,6H2,1-5H3,(H,24,29)InChIKey
PHWFUYGUYFZXDZ-UHFFFAOYSA-NSynonyms
4tertbutylN(5(3ethyl(124)triazolo(34b)(134)thiadiazol6yl)2methoxyphenyl)benzamide
CCC1=NN=C2N1N=C(S2)C3=CC(=C(C=C3)OC)NC(=O)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC23H25N5O2Sc161925262228(19)2721(3122)1591218(305)17(1315)2420(29)1471016(11814)23(23)4h713H6H215H3(H2429)
MFCD09233945
ZINC000010010201
ZINC10010201
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