Vitas-M small molecule compound
2-amino-1-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-N-[2-(4-methoxyphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Catalog ID
STL226092
SMILES COc1ccc(cc1)CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1ccc(c(c1)OC)OC
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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 C29H28N6O4 MW 524.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N6O4/c1-37-20-11-8-18(9-12-20)14-15-31-29(36)25-26-28(34-22-7-5-4-6-21(22)33-26)35(27(25)30)32-17-19-10-13-23(38-2)24(16-19)39-3/h4-13,16-17H,14-15,30H2,1-3H3,(H,31,36)/b32-17+InChIKey
AICIZHOIHHQWHU-VTNSRFBWSA-NSynonyms
839698-66-7(E)2amino1((34dimethoxybenzylidene)amino)N(4methoxyphenethyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1(((E)(34dimethoxyphenyl)methylidene)amino)N(2(4methoxyphenyl)ethyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINO1((E)(34DIMETHOXYPHENYL)METHYLIDENEAMINO)N(2(4METHOXYPHENYL)ETHYL)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
839698667
COC1=CC=C(C=C1)CCNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)N=CC5=CC(=C(C=C5)OC)OC)N
COc1ccc(cc1)CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)N=Cc1ccc(c(c1)OC)OC
InChI=1SC29H28N6O4c1372011818(91220)14153129(36)252628(3422754621(22)3326)35(27(25)30)321719101323(382)24(1619)393h4131617H141530H213H3(H3136)b3217+
MFCD03692587
ZINC000002254212
ZINC33351688
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.