Vitas-M small molecule compound
2-{[4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(trifluoromethyl)phenyl]acetamide
Catalog ID
STL016963
SMILES O=C(Nc1ccc(cc1)C(F)(F)F)CSc1nnc(n1c1ccccc1)c1ccncc1
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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 C22H16F3N5OS MW 455.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16F3N5OS/c23-22(24,25)16-6-8-17(9-7-16)27-19(31)14-32-21-29-28-20(15-10-12-26-13-11-15)30(21)18-4-2-1-3-5-18/h1-13H,14H2,(H,27,31)InChIKey
PDPIJAOUPWIPSK-UHFFFAOYSA-NSynonyms
2((4phenyl5(pyridin4yl)4H124triazol3yl)sulfanyl)N(4(trifluoromethyl)phenyl)acetamide
2((4PHENYL5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)N(4(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
2(4PHENYL5(4PYRIDYL)(124TRIAZOL3YLTHIO))N(4(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)C(F)(F)F)C4=CC=NC=C4
InChI=1SC22H16F3N5OSc2322(2425)166817(9716)2719(31)143221292820(15101226131115)30(21)184213518h113H14H2(H2731)
MFCD04036228
ZINC000001454225
ZINC01454225
ZINC1454225
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