Vitas-M small molecule compound
N-(5-tert-butyl-2-hydroxyphenyl)-2-[(5-{[(4-fluorophenyl)(methylsulfonyl)amino]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Catalog ID
STL365666
SMILES O=C(Nc1cc(ccc1O)C(C)(C)C)CSc1nnc(n1C)CN(S(=O)(=O)C)c1ccc(cc1)F
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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 C23H28FN5O4S2 MW 521.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28FN5O4S2/c1-23(2,3)15-6-11-19(30)18(12-15)25-21(31)14-34-22-27-26-20(28(22)4)13-29(35(5,32)33)17-9-7-16(24)8-10-17/h6-12,30H,13-14H2,1-5H3,(H,25,31)InChIKey
GRMUKIKOHDKIAV-UHFFFAOYSA-NSynonyms
CC(C)(C)C1=CC(=C(C=C1)O)NC(=O)CSC2=NN=C(N2C)CN(C3=CC=C(C=C3)F)S(=O)(=O)C
InChI=1SC23H28FN5O4S2c123(23)1561119(30)18(1215)2521(31)143422272620(28(22)4)1329(35(532)33)179716(24)81017h61230H1314H215H3(H2531)
MFCD27591700
N(5tertbutyl2hydroxyphenyl)2((5(((4fluorophenyl)(methylsulfonyl)amino)methyl)4methyl4H124triazol3yl)sulfanyl)acetamide
N(5tertbutyl2hydroxyphenyl)2((5((4fluoroNmethylsulfonylanilino)methyl)4methyl124triazol3yl)sulfanyl)acetamide
ZINC000020416281
ZINC20416281
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