Vitas-M small molecule compound
(2E)-N-(5-{[2-(1,2-dihydroacenaphthylen-5-ylamino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenylprop-2-enamide
Catalog ID
STK061554
SMILES O=C(Nc1nnc(s1)SCC(=O)Nc1ccc2c3c1cccc3CC2)/C=C/c1ccccc1
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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 C25H20N4O2S2 MW 472.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N4O2S2/c30-21(14-9-16-5-2-1-3-6-16)27-24-28-29-25(33-24)32-15-22(31)26-20-13-12-18-11-10-17-7-4-8-19(20)23(17)18/h1-9,12-14H,10-11,15H2,(H,26,31)(H,27,28,30)/b14-9+InChIKey
XFMWWCBSVMOFKZ-NTEUORMPSA-NSynonyms
(2E)N(5((2(12DIHYDROACENAPHTHYLEN5YLAMINO)2OXOETHYL)SULFANYL)134THIADIAZOL2YL)3PHENYLPROP2ENAMIDE
(E)N(5(2(12DIHYDROACENAPHTHYLEN5YLAMINO)2OXOETHYL)SULFANYL134THIADIAZOL2YL)3PHENYLPROP2ENAMIDE
C1CC2=CC=CC3=C(C=CC1=C23)NC(=O)CSC4=NN=C(S4)NC(=O)C=CC5=CC=CC=C5
InChI=1SC25H20N4O2S2c3021(149165213616)2724282925(3324)321522(31)262013121811101774819(20)23(17)18h191214H101115H2(H2631)(H272830)b149+
MFCD03356374
O=C(Nc1nnc(s1)SCC(=O)Nc1ccc2c3c1cccc3CC2)C=Cc1ccccc1
STK061554
ZINC000001147665
ZINC01147665
ZINC1147665
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