Vitas-M small molecule compound
[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl](3,6-dichloro-1-benzothiophen-2-yl)methanone
Catalog ID
STK423526
SMILES Clc1ccc2c(c1)sc(c2Cl)C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2
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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 C21H18Cl2N2O3S MW 449.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18Cl2N2O3S/c22-14-2-3-15-18(10-14)29-20(19(15)23)21(26)25-7-5-24(6-8-25)11-13-1-4-16-17(9-13)28-12-27-16/h1-4,9-10H,5-8,11-12H2InChIKey
DMPKOXFQFUWYAR-UHFFFAOYSA-NSynonyms
(4(13benzodioxol5ylmethyl)piperazin1yl)(36dichloro1benzothiophen2yl)methanone
4(2HBENZO(34D)13DIOXOLEN5YLMETHYL)PIPERAZINYL36DICHLOROBENZO(B)THIOPHEN2YLKETONE
C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=C(C5=C(S4)C=C(C=C5)Cl)Cl
InChI=1SC21H18Cl2N2O3Sc2214231518(1014)2920(19(15)23)21(26)257524(6825)1113141617(913)28122716h14910H581112H2
MFCD02373342
ZINC000013134647
ZINC13134647
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