Vitas-M small molecule compound

N-[2-(butan-2-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl]-3-methylbenzamide

Catalog ID
STL137482
SMILES CCC(c1nn2c(s1)ncc(c2=O)NC(=O)c1cccc(c1)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 C17H18N4O2S MW 342.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4O2S/c1-4-11(3)15-20-21-16(23)13(9-18-17(21)24-15)19-14(22)12-7-5-6-10(2)8-12/h5-9,11H,4H2,1-3H3,(H,19,22)
InChIKey
HDEASJUQONYRPT-UHFFFAOYSA-N
Synonyms

CCC(C)C1=NN2C(=O)C(=CN=C2S1)NC(=O)C3=CC(=CC=C3)C
InChI=1SC17H18N4O2Sc1411(3)15202116(23)13(91817(21)2415)1914(22)1275610(2)812h5911H4H213H3(H1922)
MFCD09599228
N(2(butan2yl)5oxo5H(134)thiadiazolo(32a)pyrimidin6yl)3methylbenzamide
N(2butan2yl5oxo(134)thiadiazolo(32a)pyrimidin6yl)3methylbenzamide
ZINC000014291556
ZINC000014291557

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Available files

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