Vitas-M small molecule compound
N-{[5-({2-[(2-ethyl-6-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}-4-fluorobenzamide
Catalog ID
STL124043
SMILES C=CCn1c(CNC(=O)c2ccc(cc2)F)nnc1SCC(=O)Nc1c(C)cccc1CC
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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 C24H26FN5O2S MW 467.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26FN5O2S/c1-4-13-30-20(14-26-23(32)18-9-11-19(25)12-10-18)28-29-24(30)33-15-21(31)27-22-16(3)7-6-8-17(22)5-2/h4,6-12H,1,5,13-15H2,2-3H3,(H,26,32)(H,27,31)InChIKey
RFTXJBOSHNPHMC-UHFFFAOYSA-NSynonyms
CCC1=CC=CC(=C1NC(=O)CSC2=NN=C(N2CC=C)CNC(=O)C3=CC=C(C=C3)F)C
InChI=1SC24H26FN5O2Sc14133020(142623(32)1891119(25)121018)282924(30)331521(31)272216(3)76817(22)52h4612H151315H223H3(H2632)(H2731)
MFCD05992028
N((5((2((2ethyl6methylphenyl)amino)2oxoethyl)sulfanyl)4(prop2en1yl)4H124triazol3yl)methyl)4fluorobenzamide
N((5(2(2ETHYL6METHYLANILINO)2OXOETHYL)SULFANYL4PROP2ENYL124TRIAZOL3YL)METHYL)4FLUOROBENZAMIDE
ZINC000002859397
ZINC02859397
ZINC2859397
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