Vitas-M small molecule compound
2-[(4-ethyl-5-{[(4-fluorophenyl)(methylsulfonyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methylcyclohexyl)acetamide
Catalog ID
STL365740
SMILES CCn1c(SCC(=O)NC2CCCCC2C)nnc1CN(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 C21H30FN5O3S2 MW 483.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30FN5O3S2/c1-4-26-19(13-27(32(3,29)30)17-11-9-16(22)10-12-17)24-25-21(26)31-14-20(28)23-18-8-6-5-7-15(18)2/h9-12,15,18H,4-8,13-14H2,1-3H3,(H,23,28)InChIKey
CIKRFVBQDXQSIY-UHFFFAOYSA-NSynonyms
2((4ethyl5(((4fluorophenyl)(methylsulfonyl)amino)methyl)4H124triazol3yl)sulfanyl)N(2methylcyclohexyl)acetamide
2((4ethyl5((4fluoroNmethylsulfonylanilino)methyl)124triazol3yl)sulfanyl)N(2methylcyclohexyl)acetamide
CCN1C(=NN=C1SCC(=O)NC2CCCCC2C)CN(C3=CC=C(C=C3)F)S(=O)(=O)C
InChI=1SC21H30FN5O3S2c142619(1327(32(329)30)1711916(22)101217)242521(26)311420(28)2318865715(18)2h9121518H481314H213H3(H2328)
MFCD27591719
ZINC000020416464
ZINC000036067468
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