Vitas-M small molecule compound
2-[(5-{2-[(2-fluorophenyl)amino]-2-oxoethyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-hydroxy-5-methylphenyl)acetamide
Catalog ID
STK267222
SMILES O=C(Nc1cc(C)ccc1O)CSc1nnc(n1C)CC(=O)Nc1ccccc1F
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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 C20H20FN5O3S MW 429.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20FN5O3S/c1-12-7-8-16(27)15(9-12)23-19(29)11-30-20-25-24-17(26(20)2)10-18(28)22-14-6-4-3-5-13(14)21/h3-9,27H,10-11H2,1-2H3,(H,22,28)(H,23,29)InChIKey
OEOKYJCHIJHMEX-UHFFFAOYSA-NSynonyms
2((5(2((2FLUOROPHENYL)AMINO)2OXOETHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)N(2HYDROXY5METHYLPHENYL)ACETAMIDE
CC1=CC(=C(C=C1)O)NC(=O)CSC2=NN=C(N2C)CC(=O)NC3=CC=CC=C3F
InChI=1SC20H20FN5O3Sc1127816(27)15(912)2319(29)113020252417(26(20)2)1018(28)2214643513(14)21h3927H1011H212H3(H2228)(H2329)
MFCD09267863
N(2FLUOROPHENYL)2(5((2HYDROXY5METHYLPHENYLCARBAMOYL)METHYLSULFANYL)4METHYL4H(124)TRIAZOL3YL)ACETAMIDE
N(2fluorophenyl)2(5(2(2hydroxy5methylanilino)2oxoethyl)sulfanyl4methyl124triazol3yl)acetamide
ZINC000009583042
ZINC09583042
ZINC9583042
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