Vitas-M small molecule compound
(5Z)-2-(azepan-1-yl)-5-(4-butoxybenzylidene)-1,3-thiazol-4(5H)-one
Catalog ID
STK823157
SMILES CCCCOc1ccc(cc1)/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 C20H26N2O2S MW 358.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N2O2S/c1-2-3-14-24-17-10-8-16(9-11-17)15-18-19(23)21-20(25-18)22-12-6-4-5-7-13-22/h8-11,15H,2-7,12-14H2,1H3/b18-15-InChIKey
LJEKYTLXAFQBFR-SDXDJHTJSA-NSynonyms
(5Z)2(AZEPAN1YL)5((4BUTOXYPHENYL)METHYLIDENE)13THIAZOL4ONE
(5Z)2(azepan1yl)5(4butoxybenzylidene)13thiazol4(5H)one
(E)2(azepan1yl)5(4butoxybenzylidene)thiazol4(5H)one
CCCCOC1=CC=C(C=C1)C=C2C(=O)N=C(S2)N3CCCCCC3
CCCCOc1ccc(cc1)C=C1SC(=NC1=O)N1CCCCCC1
InChI=1SC20H26N2O2Sc12314241710816(91117)151819(23)2120(2518)221264571322h81115H271214H21H3b1815
MFCD03463700
ZINC000027018665
ZINC27018665
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