Vitas-M small molecule compound
2-amino-1-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-N-(3,5-dimethylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Catalog ID
STK990817
SMILES COc1cc(ccc1OC)/C=N/n1c2nc3ccccc3nc2c(c1N)C(=O)Nc1cc(C)cc(c1)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 C28H26N6O3 MW 494.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N6O3/c1-16-11-17(2)13-19(12-16)31-28(35)24-25-27(33-21-8-6-5-7-20(21)32-25)34(26(24)29)30-15-18-9-10-22(36-3)23(14-18)37-4/h5-15H,29H2,1-4H3,(H,31,35)/b30-15+InChIKey
UNQABBLPFCOBFN-FJEPWZHXSA-NSynonyms
577700-49-3(E)2amino1((34dimethoxybenzylidene)amino)N(35dimethylphenyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1(((E)(34dimethoxyphenyl)methylidene)amino)N(35dimethylphenyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINO1((E)(34DIMETHOXYPHENYL)METHYLIDENEAMINO)N(35DIMETHYLPHENYL)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
577700493
CC1=CC(=CC(=C1)NC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)N=CC5=CC(=C(C=C5)OC)OC)N)C
COc1cc(ccc1OC)C=Nn1c2nc3ccccc3nc2c(c1N)C(=O)Nc1cc(C)cc(c1)C
InChI=1SC28H26N6O3c1161117(2)1319(1216)3128(35)242527(3321865720(21)3225)34(26(24)29)30151891022(363)23(1418)374h515H29H214H3(H3135)b3015+
MFCD04027922
ZINC000002382588
ZINC33364345
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