Vitas-M small molecule compound
N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(4-benzylpiperidin-1-yl)quinoxalin-2-yl]-2-cyanoacetamide
Catalog ID
STK534573
SMILES N#CC(c1nc2ccccc2nc1N1CCC(CC1)Cc1ccccc1)C(=O)NCc1ccc2c(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 C31H29N5O3 MW 519.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N5O3/c32-18-24(31(37)33-19-23-10-11-27-28(17-23)39-20-38-27)29-30(35-26-9-5-4-8-25(26)34-29)36-14-12-22(13-15-36)16-21-6-2-1-3-7-21/h1-11,17,22,24H,12-16,19-20H2,(H,33,37)InChIKey
UZBSRGUPVDNRLT-UHFFFAOYSA-NSynonyms
C1CN(CCC1CC2=CC=CC=C2)C3=NC4=CC=CC=C4N=C3C(C#N)C(=O)NCC5=CC6=C(C=C5)OCO6
InChI=1SC31H29N5O3c321824(31(37)33192310112728(1723)39203827)2930(3526954825(26)3429)36141222(131536)16216213721h111172224H12161920H2(H3337)
MFCD02997380
N(13benzodioxol5ylmethyl)2(3(4benzylpiperidin1yl)quinoxalin2yl)2cyanoacetamide
N(benzo(d)(13)dioxol5ylmethyl)2(3(4benzylpiperidin1yl)quinoxalin2yl)2cyanoacetamide
ZINC000012311657
ZINC000012311658
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