Vitas-M small molecule compound
2-amino-1-{[(E)-(4-tert-butylphenyl)methylidene]amino}-N-(2-phenylethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Catalog ID
STL226085
SMILES O=C(c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1ccc(cc1)C(C)(C)C)NCCc1ccccc1
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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 C30H30N6O MW 490.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N6O/c1-30(2,3)22-15-13-21(14-16-22)19-33-36-27(31)25(29(37)32-18-17-20-9-5-4-6-10-20)26-28(36)35-24-12-8-7-11-23(24)34-26/h4-16,19H,17-18,31H2,1-3H3,(H,32,37)/b33-19+InChIKey
QKYQDYCWSJNZLB-HNSNBQBZSA-NSynonyms
835908-31-1(E)2amino1((4(tertbutyl)benzylidene)amino)Nphenethyl1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1(((E)(4tertbutylphenyl)methylidene)amino)N(2phenylethyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1((E)(4tertbutylphenyl)methylideneamino)N(2phenylethyl)pyrrolo(32b)quinoxaline3carboxamide
2AMINO1((E)(4TERTBUTYLPHENYL)METHYLIDENEAMINO)NPHENETHYLPYRROLO(32B)QUINOXALINE3CARBOXAMIDE
835908311
CC(C)(C)C1=CC=C(C=C1)C=NN2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCCC5=CC=CC=C5)N
InChI=1SC30H30N6Oc130(23)22151321(141622)19333627(31)25(29(37)3218172095461020)2628(36)352412871123(24)3426h41619H171831H213H3(H3237)b3319+
MFCD03686801
O=C(c1c(N)n(c2c1nc1ccccc1n2)N=Cc1ccc(cc1)C(C)(C)C)NCCc1ccccc1
ZINC000002249083
ZINC2249082
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.