Vitas-M small molecule compound
2-fluoro-N-{4-[4-methyl-5-({2-[2-(prop-2-en-1-yl)phenoxy]ethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]phenyl}benzamide
Catalog ID
STL335880
SMILES C=CCc1ccccc1OCCSc1nnc(n1C)c1ccc(cc1)NC(=O)c1ccccc1F
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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 C27H25FN4O2S MW 488.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25FN4O2S/c1-3-8-19-9-4-7-12-24(19)34-17-18-35-27-31-30-25(32(27)2)20-13-15-21(16-14-20)29-26(33)22-10-5-6-11-23(22)28/h3-7,9-16H,1,8,17-18H2,2H3,(H,29,33)InChIKey
KTTJFVFQPYHENX-UHFFFAOYSA-NSynonyms
445421-49-82fluoroN(4(4methyl5((2(2(prop2en1yl)phenoxy)ethyl)sulfanyl)4H124triazol3yl)phenyl)benzamide
2FLUORON(4(4METHYL5(2(2PROP2ENYLPHENOXY)ETHYLSULFANYL)124TRIAZOL3YL)PHENYL)BENZAMIDE
445421498
CN1C(=NN=C1SCCOC2=CC=CC=C2CC=C)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4F
InChI=1SC27H25FN4O2Sc138199471224(19)3417183527313025(32(27)2)20131521(161420)2926(33)2210561123(22)28h37916H181718H22H3(H2933)
MFCD03079893
N(4(5((2(2ALLYLPHENOXY)ETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)PHENYL)2FLUOROBENZAMIDE
N(4(5((2(2allylphenoxy)ethyl)thio)4methyl4H124triazol3yl)phenyl)2fluorobenzamide
ZINC000002185517
ZINC02185517
ZINC2185517
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