Vitas-M small molecule compound

2-amino-1-(3-butoxyphenyl)-N-(6-methylheptan-2-yl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

Catalog ID
STK584641
SMILES CCCCOc1cccc(c1)n1c2nc3ccccc3nc2c(c1N)C(=O)NC(CCCC(C)C)C

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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 C29H37N5O2 MW 487.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H37N5O2/c1-5-6-17-36-22-14-10-13-21(18-22)34-27(30)25(29(35)31-20(4)12-9-11-19(2)3)26-28(34)33-24-16-8-7-15-23(24)32-26/h7-8,10,13-16,18-20H,5-6,9,11-12,17,30H2,1-4H3,(H,31,35)
InChIKey
ZWOWADAZJGMGGW-UHFFFAOYSA-N
Synonyms
396724-71-3
2amino1(3butoxyphenyl)N(6methylheptan2yl)1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINO1(3BUTOXYPHENYL)N(6METHYLHEPTAN2YL)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
396724713
CCCCOC1=CC=CC(=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NC(C)CCCC(C)C)N
InChI=1SC29H37N5O2c15617362214101321(1822)3427(30)25(29(35)3120(4)1291119(2)3)2628(34)332416871523(24)3226h781013161820H56911121730H214H3(H3135)
MFCD02163057
ZINC000002204255
ZINC000002204256

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Available files

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