Vitas-M small molecule compound
N-[1-(4-methyl-5-{[2-oxo-2-(pyridin-3-ylamino)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Catalog ID
STL182608
SMILES O=C(Nc1cccnc1)CSc1nnc(n1C)C(NC(=O)c1ccccc1)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 C19H20N6O2S MW 396.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N6O2S/c1-13(21-18(27)14-7-4-3-5-8-14)17-23-24-19(25(17)2)28-12-16(26)22-15-9-6-10-20-11-15/h3-11,13H,12H2,1-2H3,(H,21,27)(H,22,26)InChIKey
XLTRPVGXKNJVNZ-UHFFFAOYSA-NSynonyms
CC(C1=NN=C(N1C)SCC(=O)NC2=CN=CC=C2)NC(=O)C3=CC=CC=C3
InChI=1SC19H20N6O2Sc113(2118(27)147435814)17232419(25(17)2)281216(26)22159610201115h31113H12H212H3(H2127)(H2226)
MFCD22125521
N(1(4methyl5((2oxo2(pyridin3ylamino)ethyl)sulfanyl)4H124triazol3yl)ethyl)benzamide
N(1(4methyl5(2oxo2(pyridin3ylamino)ethyl)sulfanyl124triazol3yl)ethyl)benzamide
ZINC000072191596
ZINC000072191597
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