Vitas-M small molecule compound
3-(4-benzylpiperazin-1-yl)-4-[(3,4-dimethoxybenzyl)amino]cyclobut-3-ene-1,2-dione
Catalog ID
STL159953
SMILES COc1cc(CNC2=C(C(=O)C2=O)N2CCN(CC2)Cc2ccccc2)ccc1OC
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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 C24H27N3O4 MW 421.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N3O4/c1-30-19-9-8-18(14-20(19)31-2)15-25-21-22(24(29)23(21)28)27-12-10-26(11-13-27)16-17-6-4-3-5-7-17/h3-9,14,25H,10-13,15-16H2,1-2H3InChIKey
GEPORLURMBCLOQ-UHFFFAOYSA-NSynonyms
1282117-01-41282117014
3(4benzylpiperazin1yl)4((34dimethoxybenzyl)amino)cyclobut3ene12dione
3(4benzylpiperazin1yl)4((34dimethoxyphenyl)methylamino)cyclobut3ene12dione
COC1=C(C=C(C=C1)CNC2=C(C(=O)C2=O)N3CCN(CC3)CC4=CC=CC=C4)OC
InChI=1SC24H27N3O4c130199818(1420(19)312)15252122(24(29)23(21)28)27121026(111327)16176435717h391425H10131516H212H3
MFCD18799850
ZINC000101702341
ZINC101702341
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