Vitas-M small molecule compound

Catalog ID
STL316647
SMILES O=C(N1CCCC(C1)c1nnc2n1cccc2)COc1cccc2c1nsn2

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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 C19H18N6O2S MW 394.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N6O2S/c26-17(12-27-15-7-3-6-14-18(15)23-28-22-14)24-9-4-5-13(11-24)19-21-20-16-8-1-2-10-25(16)19/h1-3,6-8,10,13H,4-5,9,11-12H2
InChIKey
QEARDRQZNROJDR-UHFFFAOYSA-N
Synonyms
951940-40-2
1(3((124)triazolo(43a)pyridin3yl)piperidin1yl)2(benzo(c)(125)thiadiazol4yloxy)ethanone
2(213benzothiadiazol4yloxy)1(3((124)triazolo(43a)pyridin3yl)piperidin1yl)ethanone
951940402
C1CC(CN(C1)C(=O)COC2=CC=CC3=NSN=C32)C4=NN=C5N4C=CC=C5
InChI=1SC19H18N6O2Sc2617(1227157361418(15)23282214)2494513(1124)192120168121025(16)19h13681013H4591112H2
MFCD28027938
ZINC000013719310
ZINC000013719315

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Available files

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