Vitas-M small molecule compound
1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-[(4-bromobenzyl)sulfanyl]ethanone
Catalog ID
STK357504
SMILES Brc1ccc(cc1)CSCC(=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 C21H23BrN2O3S MW 463.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23BrN2O3S/c22-18-4-1-16(2-5-18)13-28-14-21(25)24-9-7-23(8-10-24)12-17-3-6-19-20(11-17)27-15-26-19/h1-6,11H,7-10,12-15H2InChIKey
KFHFEHGDVYIWGW-UHFFFAOYSA-NSynonyms
1(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)2((4BROMOBENZYL)SULFANYL)ETHANONE
1(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)2((4BROMOPHENYL)METHYLSULFANYL)ETHANONE
C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CSCC4=CC=C(C=C4)Br
InChI=1SC21H23BrN2O3Sc22184116(2518)13281421(25)249723(81024)1217361920(1117)27152619h1611H7101215H2
MFCD06624306
ZINC000020102425
ZINC20102425
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