Vitas-M small molecule compound
2-amino-1-(1,3-benzodioxol-5-ylmethyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Catalog ID
STL327910
SMILES COc1cc(CCNC(=O)c2c(N)n(c3c2nc2ccccc2n3)Cc2ccc3c(c2)OCO3)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 C29H27N5O5 MW 525.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N5O5/c1-36-21-9-7-17(13-23(21)37-2)11-12-31-29(35)25-26-28(33-20-6-4-3-5-19(20)32-26)34(27(25)30)15-18-8-10-22-24(14-18)39-16-38-22/h3-10,13-14H,11-12,15-16,30H2,1-2H3,(H,31,35)InChIKey
JWZQHMZMLOLTRD-UHFFFAOYSA-NSynonyms
372972-76-42amino1(13benzodioxol5ylmethyl)N(2(34dimethoxyphenyl)ethyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINO1(13BENZODIOXOL5YLMETHYL)N(2(34DIMETHOXYPHENYL)ETHYL)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
2amino1(benzo(d)(13)dioxol5ylmethyl)N(34dimethoxyphenethyl)1Hpyrrolo(23b)quinoxaline3carboxamide
372972764
COC1=C(C=C(C=C1)CCNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5=CC6=C(C=C5)OCO6)N)OC
InChI=1SC29H27N5O5c136219717(1323(21)372)11123129(35)252628(3320643519(20)3226)34(27(25)30)15188102224(1418)39163822h3101314H1112151630H212H3(H3135)
MFCD01955104
ZINC000003310980
ZINC03310980
ZINC3310980
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