Vitas-M small molecule compound
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-{[5-(4-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL298857
SMILES C=CCn1c(SCC(=O)Nc2ccc(c(c2)C(F)(F)F)Cl)nnc1c1ccc(cc1)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 C21H18ClF3N4OS MW 466.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClF3N4OS/c1-3-10-29-19(14-6-4-13(2)5-7-14)27-28-20(29)31-12-18(30)26-15-8-9-17(22)16(11-15)21(23,24)25/h3-9,11H,1,10,12H2,2H3,(H,26,30)InChIKey
OHFLMJCRDDTNFI-UHFFFAOYSA-NSynonyms
862184-89-22((4allyl5(ptolyl)4H124triazol3yl)thio)N(4chloro3(trifluoromethyl)phenyl)acetamide
862184892
CC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F
InChI=1SC21H18ClF3N4OSc13102919(146413(2)5714)272820(29)311218(30)26158917(22)16(1115)21(2324)25h3911H11012H22H3(H2630)
MFCD05687858
N(4chloro3(trifluoromethyl)phenyl)2((5(4methylphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetamide
N(4CHLORO3(TRIFLUOROMETHYL)PHENYL)2((5(4METHYLPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4CHLORO3(TRIFLUOROMETHYL)PHENYL)2(5(4METHYLPHENYL)4PROP2ENYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000009499378
ZINC09499378
ZINC9499378
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