Vitas-M small molecule compound
1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-5-(1,2-dithiolan-3-yl)pentan-1-one
Catalog ID
STL311853
SMILES O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)CCCCC1SSCC1
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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 C20H28N2O3S2 MW 408.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N2O3S2/c23-20(4-2-1-3-17-7-12-26-27-17)22-10-8-21(9-11-22)14-16-5-6-18-19(13-16)25-15-24-18/h5-6,13,17H,1-4,7-12,14-15H2InChIKey
CWHSIKNPHGRTJU-UHFFFAOYSA-NSynonyms
1088845-00-41(4(13benzodioxol5ylmethyl)piperazin1yl)5(12dithiolan3yl)pentan1one
1(4(13benzodioxol5ylmethyl)piperazin1yl)5(dithiolan3yl)pentan1one
1(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)5(12dithiolan3yl)pentan1one
1088845004
C1CSSC1CCCCC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4
InChI=1SC20H28N2O3S2c2320(421317712262717)2210821(91122)1416561819(1316)25152418h561317H147121415H2
MFCD08294299
ZINC000079474752
ZINC000079474759
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