Vitas-M small molecule compound
3-methyl-N-(2-{4-methyl-5-[(2-oxo-2-{[3-(trifluoromethyl)phenyl]amino}ethyl)sulfanyl]-4H-1,2,4-triazol-3-yl}ethyl)benzamide
Catalog ID
STL139264
SMILES O=C(Nc1cccc(c1)C(F)(F)F)CSc1nnc(n1C)CCNC(=O)c1cccc(c1)C
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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 C22H22F3N5O2S MW 477.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22F3N5O2S/c1-14-5-3-6-15(11-14)20(32)26-10-9-18-28-29-21(30(18)2)33-13-19(31)27-17-8-4-7-16(12-17)22(23,24)25/h3-8,11-12H,9-10,13H2,1-2H3,(H,26,32)(H,27,31)InChIKey
SXDYKEORJPGJNM-UHFFFAOYSA-NSynonyms
3methylN(2(4methyl5((2oxo2((3(trifluoromethyl)phenyl)amino)ethyl)sulfanyl)4H124triazol3yl)ethyl)benzamide
3METHYLN(2(4METHYL5(2OXO2(3(TRIFLUOROMETHYL)ANILINO)ETHYL)SULFANYL124TRIAZOL3YL)ETHYL)BENZAMIDE
CC1=CC=CC(=C1)C(=O)NCCC2=NN=C(N2C)SCC(=O)NC3=CC=CC(=C3)C(F)(F)F
InChI=1SC22H22F3N5O2Sc11453615(1114)20(32)2610918282921(30(18)2)331319(31)271784716(1217)22(2324)25h381112H91013H212H3(H2632)(H2731)
MFCD05111270
ZINC000002859384
ZINC02859384
ZINC2859384
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