Vitas-M small molecule compound
4-(2,4-dichlorobenzyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazine-1-carbothioamide
Catalog ID
STK398450
SMILES Clc1ccc(c(c1)Cl)CN1CCN(CC1)C(=S)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 C20H21Cl2N3O2S MW 438.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21Cl2N3O2S/c21-15-2-1-14(17(22)11-15)13-24-5-7-25(8-6-24)20(28)23-16-3-4-18-19(12-16)27-10-9-26-18/h1-4,11-12H,5-10,13H2,(H,23,28)InChIKey
WMUHOWHQKRRNFE-UHFFFAOYSA-NSynonyms
(2H3HBENZO(34E)14DIOXIN6YLAMINO)(4((24DICHLOROPHENYL)METHYL)PIPERAZINYL)METHANE1THIONE
4((24dichlorophenyl)methyl)N(23dihydro14benzodioxin6yl)piperazine1carbothioamide
4(24dichlorobenzyl)N(23dihydro14benzodioxin6yl)piperazine1carbothioamide
C1CN(CCN1CC2=C(C=C(C=C2)Cl)Cl)C(=S)NC3=CC4=C(C=C3)OCCO4
InChI=1SC20H21Cl2N3O2Sc21152114(17(22)1115)13245725(8624)20(28)2316341819(1216)271092618h141112H51013H2(H2328)
MFCD04059240
ZINC000017101998
ZINC17101998
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