Vitas-M small molecule compound
{4-[4-(methylsulfanyl)benzyl]piperazin-1-yl}(3,4,5-trimethoxyphenyl)methanone
Catalog ID
STK133236
SMILES CSc1ccc(cc1)CN1CCN(CC1)C(=O)c1cc(OC)c(c(c1)OC)OC
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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 C22H28N2O4S MW 416.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N2O4S/c1-26-19-13-17(14-20(27-2)21(19)28-3)22(25)24-11-9-23(10-12-24)15-16-5-7-18(29-4)8-6-16/h5-8,13-14H,9-12,15H2,1-4H3InChIKey
UQFGHABOOJIKNQ-UHFFFAOYSA-NSynonyms
(4((4METHYLSULFANYLPHENYL)METHYL)PIPERAZIN1YL)(345TRIMETHOXYPHENYL)METHANONE
(4(4(METHYLSULFANYL)BENZYL)PIPERAZIN1YL)(345TRIMETHOXYPHENYL)METHANONE
COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)SC
InChI=1SC22H28N2O4Sc126191317(1420(272)21(19)283)22(25)2411923(101224)15165718(294)8616h581314H91215H214H3
MFCD01825872
ZINC000019608265
ZINC19608265
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