Vitas-M small molecule compound

(2E)-3-[5-(morpholin-4-yl)-1,2,3-thiadiazol-4-yl]-1-(naphthalen-2-yl)prop-2-en-1-one

Catalog ID
STL447244
SMILES O=C(c1ccc2c(c1)cccc2)/C=C/c1nnsc1N1CCOCC1

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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 C19H17N3O2S MW 351.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O2S/c23-18(16-6-5-14-3-1-2-4-15(14)13-16)8-7-17-19(25-21-20-17)22-9-11-24-12-10-22/h1-8,13H,9-12H2/b8-7+
InChIKey
JGZIWCANTFTYQK-BQYQJAHWSA-N
Synonyms

(2E)3(5(morpholin4yl)123thiadiazol4yl)1(naphthalen2yl)prop2en1one
(E)3(5MORPHOLIN4YL(123)THIADIAZOL4YL)1NAPHTHALEN2YLPROPENONE
(E)3(5MORPHOLIN4YLTHIADIAZOL4YL)1NAPHTHALEN2YLPROP2EN1ONE
C1COCCN1C2=C(N=NS2)C=CC(=O)C3=CC4=CC=CC=C4C=C3
InChI=1SC19H17N3O2Sc2318(166514312415(14)1316)871719(25212017)2291124121022h1813H912H2b87+
MFCD06242602
O=C(c1ccc2c(c1)cccc2)C=Cc1nnsc1N1CCOCC1
ZINC000005242877
ZINC05242877
ZINC5242877

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Available files

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