Vitas-M small molecule compound
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(2E)-3-phenylprop-2-en-1-yl]piperazine-1-carbothioamide
Catalog ID
STK446911
SMILES S=C(N1CCN(CC1)C/C=C/c1ccccc1)Nc1ccc2c(c1)OCCO2
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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 C22H25N3O2S MW 395.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O2S/c28-22(23-19-8-9-20-21(17-19)27-16-15-26-20)25-13-11-24(12-14-25)10-4-7-18-5-2-1-3-6-18/h1-9,17H,10-16H2,(H,23,28)/b7-4+InChIKey
QQRKVAJZZANPHO-QPJJXVBHSA-NSynonyms
(4((2E)3PHENYLPROP2ENYL)PIPERAZINYL)(2H3HBENZO(34E)14DIOXIN6YLAMINO)METHANE1THIONE
C1CN(CCN1CC=CC2=CC=CC=C2)C(=S)NC3=CC4=C(C=C3)OCCO4
InChI=1SC22H25N3O2Sc2822(2319892021(1719)2716152620)25131124(121425)1047185213618h1917H1016H2(H2328)b74+
MFCD04059208
N(23dihydro14benzodioxin6yl)4((2E)3phenylprop2en1yl)piperazine1carbothioamide
N(23DIHYDRO14BENZODIOXIN6YL)4((E)3PHENYLPROP2ENYL)PIPERAZINE1CARBOTHIOAMIDE
S=C(N1CCN(CC1)CC=Cc1ccccc1)Nc1ccc2c(c1)OCCO2
ZINC000055057229
ZINC55057229
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