Vitas-M small molecule compound

2-{[4-(2-methylpropyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methyl-1,3-thiazol-2-yl)propanamide

Catalog ID
STK256809
SMILES CC(Cn1c(nnc1c1ccncc1)SC(C(=O)Nc1scc(n1)C)C)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 C18H22N6OS2 MW 402.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N6OS2/c1-11(2)9-24-15(14-5-7-19-8-6-14)22-23-18(24)27-13(4)16(25)21-17-20-12(3)10-26-17/h5-8,10-11,13H,9H2,1-4H3,(H,20,21,25)
InChIKey
WYWGKIPSLDGCQH-UHFFFAOYSA-N
Synonyms

2((4(2methylpropyl)5(pyridin4yl)4H124triazol3yl)sulfanyl)N(4methyl13thiazol2yl)propanamide
2((4(2methylpropyl)5pyridin4yl124triazol3yl)sulfanyl)N(4methyl13thiazol2yl)propanamide
CC1=CSC(=N1)NC(=O)C(C)SC2=NN=C(N2CC(C)C)C3=CC=NC=C3
InChI=1SC18H22N6OS2c111(2)92415(1457198614)222318(24)2713(4)16(25)21172012(3)102617h58101113H9H214H3(H202125)
MFCD08685526
ZINC000009304472
ZINC000009304475

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.