Vitas-M small molecule compound

4-butyl-N-[5-(pyridin-4-yl)-1,3,4-thiadiazol-2-yl]benzamide

Catalog ID
STK487308
SMILES CCCCc1ccc(cc1)C(=O)Nc1nnc(s1)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 C18H18N4OS MW 338.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4OS/c1-2-3-4-13-5-7-14(8-6-13)16(23)20-18-22-21-17(24-18)15-9-11-19-12-10-15/h5-12H,2-4H2,1H3,(H,20,22,23)
InChIKey
TXCKCRAVZGRNKZ-UHFFFAOYSA-N
Synonyms

(4BUTYLPHENYL)N(5(4PYRIDYL)(134THIADIAZOL2YL))CARBOXAMIDE
4butylN(5(pyridin4yl)134thiadiazol2yl)benzamide
4butylN(5pyridin4yl134thiadiazol2yl)benzamide
CCCCC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)C3=CC=NC=C3
InChI=1SC18H18N4OSc1234135714(8613)16(23)2018222117(2418)1591119121015h512H24H21H3(H202223)
MFCD09431283
ZINC000013331178
ZINC13331178

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Available files

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