Vitas-M small molecule compound
2-[3-methyl-4-(1H-pyrrol-1-yl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide
Catalog ID
STL229569
SMILES O=C(Cn1nc(n(c1=S)n1cccc1)C)Nc1ccc(cc1)OC(F)(F)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 C16H14F3N5O2S MW 397.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14F3N5O2S/c1-11-21-23(15(27)24(11)22-8-2-3-9-22)10-14(25)20-12-4-6-13(7-5-12)26-16(17,18)19/h2-9H,10H2,1H3,(H,20,25)InChIKey
NSLBNOOIVLYWIP-UHFFFAOYSA-NSynonyms
2(3methyl4(1Hpyrrol1yl)5thioxo45dihydro1H124triazol1yl)N(4(trifluoromethoxy)phenyl)acetamide
2(3methyl4pyrrol1yl5sulfanylidene124triazol1yl)N(4(trifluoromethoxy)phenyl)acetamide
CC1=NN(C(=S)N1N2C=CC=C2)CC(=O)NC3=CC=C(C=C3)OC(F)(F)F
InChI=1SC16H14F3N5O2Sc1112123(15(27)24(11)22823922)1014(25)20124613(7512)2616(1718)19h29H10H21H3(H2025)
MFCD07423062
ZINC000016777942
ZINC16777942
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