Vitas-M small molecule compound
(5Z)-2-(azepan-1-yl)-5-(4-hydroxy-3-methoxybenzylidene)-1,3-thiazol-4(5H)-one
Catalog ID
STK795334
SMILES COc1cc(ccc1O)/C=C/1\SC(=NC1=O)N1CCCCCC1
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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 C17H20N2O3S MW 332.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O3S/c1-22-14-10-12(6-7-13(14)20)11-15-16(21)18-17(23-15)19-8-4-2-3-5-9-19/h6-7,10-11,20H,2-5,8-9H2,1H3/b15-11-InChIKey
RYEAJPWCDXUMNK-PTNGSMBKSA-NSynonyms
(5Z)2(AZEPAN1YL)5((4HYDROXY3METHOXYPHENYL)METHYLIDENE)13THIAZOL4ONE
(5Z)2(azepan1yl)5(4hydroxy3methoxybenzylidene)13thiazol4(5H)one
2(HEXAHYDRO1HAZEPINE1YL)5((Z)3METHOXY4HYDROXYBENZYLIDENE)45DIHYDROTHIAZOLE4ONE
COC1=C(C=CC(=C1)C=C2C(=O)N=C(S2)N3CCCCCC3)O
COc1cc(ccc1O)C=C1SC(=NC1=O)N1CCCCCC1
InChI=1SC17H20N2O3Sc122141012(6713(14)20)111516(21)1817(2315)1984235919h67101120H2589H21H3b1511
MFCD09539026
ZINC000013547678
ZINC13547678
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