Vitas-M small molecule compound
(5Z)-2-(azepan-1-yl)-5-(4-methoxybenzylidene)-1,3-thiazol-4(5H)-one
Catalog ID
STK795744
SMILES COc1ccc(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 C17H20N2O2S MW 316.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O2S/c1-21-14-8-6-13(7-9-14)12-15-16(20)18-17(22-15)19-10-4-2-3-5-11-19/h6-9,12H,2-5,10-11H2,1H3/b15-12-InChIKey
XVNIREYOHAWVPY-QINSGFPZSA-NSynonyms
(5Z)2(AZEPAN1YL)5((4METHOXYPHENYL)METHYLIDENE)13THIAZOL4ONE
(5Z)2(azepan1yl)5(4methoxybenzylidene)13thiazol4(5H)one
2AZAPERHYDROEPINYL5((4METHOXYPHENYL)METHYLENE)13THIAZOLIN4ONE
COC1=CC=C(C=C1)C=C2C(=O)N=C(S2)N3CCCCCC3
COc1ccc(cc1)C=C1SC(=NC1=O)N1CCCCCC1
InChI=1SC17H20N2O2Sc121148613(7914)121516(20)1817(2215)191042351119h6912H251011H21H3b1512
MFCD01839725
ZINC000012420262
ZINC12420262
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