Vitas-M small molecule compound
N-(3-bromobenzyl)-N'-[2-(3,4-dimethoxyphenyl)ethyl]butanediamide
Catalog ID
STK030727
SMILES COc1cc(CCNC(=O)CCC(=O)NCc2cccc(c2)Br)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 C21H25BrN2O4 MW 449.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25BrN2O4/c1-27-18-7-6-15(13-19(18)28-2)10-11-23-20(25)8-9-21(26)24-14-16-4-3-5-17(22)12-16/h3-7,12-13H,8-11,14H2,1-2H3,(H,23,25)(H,24,26)InChIKey
MWQRIDVTBGGJLO-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)CCNC(=O)CCC(=O)NCC2=CC(=CC=C2)Br)OC
COc1cc(CCNC(=O)CCC(=O)NCc2cccc(c2)Br)ccc1OC
InChI=1SC21H25BrN2O4c127187615(1319(18)282)10112320(25)8921(26)24141643517(22)1216h371213H81114H212H3(H2325)(H2426)
MFCD08050280
N((3BROMOPHENYL)METHYL)N(2(34DIMETHOXYPHENYL)ETHYL)BUTANEDIAMIDE
N(3BROMOBENZYL)N(2(34DIMETHOXYPHENYL)ETHYL)BUTANEDIAMIDE
STK030727
ZINC000013940855
ZINC13940855
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