Vitas-M small molecule compound

N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-{[4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}butanamide

Catalog ID
STK506370
SMILES C=CCn1c(nnc1c1ccncc1)SC(C(=O)Nc1nnc(s1)C)CC

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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 C17H19N7OS2 MW 401.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N7OS2/c1-4-10-24-14(12-6-8-18-9-7-12)21-23-17(24)27-13(5-2)15(25)19-16-22-20-11(3)26-16/h4,6-9,13H,1,5,10H2,2-3H3,(H,19,22,25)
InChIKey
SVXFOOYQWXHZBM-UHFFFAOYSA-N
Synonyms

CCC(C(=O)NC1=NN=C(S1)C)SC2=NN=C(N2CC=C)C3=CC=NC=C3
InChI=1SC17H19N7OS2c14102414(1268189712)212317(24)2713(52)15(25)1916222011(3)2616h46913H1510H223H3(H192225)
MFCD13368972
N(5methyl134thiadiazol2yl)2((4(prop2en1yl)5(pyridin4yl)4H124triazol3yl)sulfanyl)butanamide
N(5methyl134thiadiazol2yl)2((4prop2enyl5pyridin4yl124triazol3yl)sulfanyl)butanamide
ZINC000020173248
ZINC000020173250

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Available files

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