Vitas-M small molecule compound
2-[(4-ethyl-5-{2-[(2-fluorophenyl)amino]-2-oxoethyl}-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylcyclohexyl)acetamide
Catalog ID
STK221562
SMILES CCn1c(SCC(=O)NC2CCCCC2C)nnc1CC(=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 C21H28FN5O2S MW 433.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28FN5O2S/c1-3-27-18(12-19(28)24-17-11-7-5-9-15(17)22)25-26-21(27)30-13-20(29)23-16-10-6-4-8-14(16)2/h5,7,9,11,14,16H,3-4,6,8,10,12-13H2,1-2H3,(H,23,29)(H,24,28)InChIKey
BYOSJYTZVWBCJK-UHFFFAOYSA-NSynonyms
2((4ETHYL5(2((2FLUOROPHENYL)AMINO)2OXOETHYL)4H124TRIAZOL3YL)SULFANYL)N(2METHYLCYCLOHEXYL)ACETAMIDE
2(4ETHYL5((2METHYLCYCLOHEXYLCARBAMOYL)METHYLSULFANYL)4H(124)TRIAZOL3YL)N(2FLUOROPHENYL)ACETAMIDE
2(4ETHYL5(2((2METHYLCYCLOHEXYL)AMINO)2OXOETHYL)SULFANYL124TRIAZOL3YL)N(2FLUOROPHENYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)NC2CCCCC2C)CC(=O)NC3=CC=CC=C3F
InChI=1SC21H28FN5O2Sc132718(1219(28)24171175915(17)22)252621(27)301320(29)23161064814(16)2h579111416H3468101213H212H3(H2329)(H2428)
MFCD07399151
ZINC000009262995
ZINC000009263004
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