Vitas-M small molecule compound

2-amino-1-(4-bromophenyl)-N-(butan-2-yl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

Catalog ID
STK920094
SMILES CCC(NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)Br)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 C21H20BrN5O MW 438.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20BrN5O/c1-3-12(2)24-21(28)17-18-20(26-16-7-5-4-6-15(16)25-18)27(19(17)23)14-10-8-13(22)9-11-14/h4-12H,3,23H2,1-2H3,(H,24,28)
InChIKey
HIOXFOMHKPLWDG-UHFFFAOYSA-N
Synonyms
841208-09-1
2AMINO1(4BROMOPHENYL)N((2R)BUTAN2YL)1HPYRROLO(23B)QUINOXALINE3CARBOXAMIDE
2AMINO1(4BROMOPHENYL)N(1METHYLPROPYL)1HPYRROLO(23B)QUINOXALINE3CARBOXAMIDE
2amino1(4bromophenyl)N(butan2yl)1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1(4bromophenyl)N(secbutyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINO1(4BROMOPHENYL)NBUTAN2YLPYRROLO(32B)QUINOXALINE3CARBOXAMIDE
841208091
CCC(C)NC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)Br)N
InChI=1SC21H20BrN5Oc1312(2)2421(28)171820(2616754615(16)2518)27(19(17)23)1410813(22)91114h412H323H212H3(H2428)
MFCD04011488
ZINC000002388302
ZINC000002388306

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.