Vitas-M small molecule compound
2-[4-(propan-2-yl)phenoxy]-N-[4-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl]acetamide
Catalog ID
STK345390
SMILES O=C(COc1ccc(cc1)C(C)C)NCc1ccc(cc1)c1nn2c(s1)nnc2
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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 C21H21N5O2S MW 407.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2S/c1-14(2)16-7-9-18(10-8-16)28-12-19(27)22-11-15-3-5-17(6-4-15)20-25-26-13-23-24-21(26)29-20/h3-10,13-14H,11-12H2,1-2H3,(H,22,27)InChIKey
WOYROIRTOJZZKJ-UHFFFAOYSA-NSynonyms
2(4(propan2yl)phenoxy)N(4((124)triazolo(34b)(134)thiadiazol6yl)benzyl)acetamide
2(4ISOPROPYLPHENOXY)N(4(124)TRIAZOLO(34B)(134)THIADIAZOL6YLBENZYL)ACETAMIDE
2(4propan2ylphenoxy)N((4((124)triazolo(34b)(134)thiadiazol6yl)phenyl)methyl)acetamide
CC(C)C1=CC=C(C=C1)OCC(=O)NCC2=CC=C(C=C2)C3=NN4C=NN=C4S3
InChI=1SC21H21N5O2Sc114(2)167918(10816)281219(27)2211153517(6415)20252613232421(26)2920h3101314H1112H212H3(H2227)
MFCD09965082
ZINC000012857041
ZINC12857041
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