Vitas-M small molecule compound
1'-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-3a,4,5,6,7,7a-hexahydrospiro[1,3-benzodioxole-2,3'-indol]-2'(1'H)-one
Catalog ID
STK734701
SMILES Clc1cccc(c1)N1CCN(CC1)CN1c2ccccc2C2(C1=O)OC1C(O2)CCCC1
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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 C25H28ClN3O3 MW 453.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28ClN3O3/c26-18-6-5-7-19(16-18)28-14-12-27(13-15-28)17-29-21-9-2-1-8-20(21)25(24(29)30)31-22-10-3-4-11-23(22)32-25/h1-2,5-9,16,22-23H,3-4,10-15,17H2InChIKey
LXVWUMKKUMLPFF-UHFFFAOYSA-NSynonyms
1((4(3chlorophenyl)piperazin1yl)methyl)3a45677ahexahydrospiro(13benzodioxole23indol)2(1H)one
1((4(3chlorophenyl)piperazin1yl)methyl)spiro(3a45677ahexahydro13benzodioxole23indole)2one
C1CCC2C(C1)OC3(O2)C4=CC=CC=C4N(C3=O)CN5CCN(CC5)C6=CC(=CC=C6)Cl
InChI=1SC25H28ClN3O3c261865719(1618)28141227(131528)172921921820(21)25(24(29)30)312210341123(22)3225h1259162223H34101517H2
MFCD06016338
ZINC000012377337
ZINC000252430817
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