Vitas-M small molecule compound
(2E)-3-[5-(morpholin-4-yl)-1,2,3-thiadiazol-4-yl]-1-(thiophen-2-yl)prop-2-en-1-one
Catalog ID
STL447246
SMILES O=C(c1cccs1)/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 C13H13N3O2S2 MW 307.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N3O2S2/c17-11(12-2-1-9-19-12)4-3-10-13(20-15-14-10)16-5-7-18-8-6-16/h1-4,9H,5-8H2/b4-3+InChIKey
YNIYNPRWUHPJOD-ONEGZZNKSA-NSynonyms
(2E)3(5(morpholin4yl)123thiadiazol4yl)1(thiophen2yl)prop2en1one
(E)3(5MORPHOLIN4YLTHIADIAZOL4YL)1THIOPHEN2YLPROP2EN1ONE
C1COCCN1C2=C(N=NS2)C=CC(=O)C3=CC=CS3
InChI=1SC13H13N3O2S2c1711(122191912)431013(20151410)1657188616h149H58H2b43+
MFCD06242603
O=C(c1cccs1)C=Cc1nnsc1N1CCOCC1
ZINC000005242881
ZINC5242881
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