Vitas-M small molecule compound
methyl 4-{(E)-[(2-amino-3-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}-1H-pyrrolo[2,3-b]quinoxalin-1-yl)imino]methyl}benzoate
Catalog ID
STK920766
SMILES COC(=O)c1ccc(cc1)/C=N/n1c2nc3ccccc3nc2c(c1N)C(=O)NCCC1=CCCCC1
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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 C28H28N6O3 MW 496.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N6O3/c1-37-28(36)20-13-11-19(12-14-20)17-31-34-25(29)23(27(35)30-16-15-18-7-3-2-4-8-18)24-26(34)33-22-10-6-5-9-21(22)32-24/h5-7,9-14,17H,2-4,8,15-16,29H2,1H3,(H,30,35)/b31-17+InChIKey
DUHUWNVBJKTSKQ-KBVAKVRCSA-NSynonyms
840516-44-1(E)methyl4(((2amino3((2(cyclohex1en1yl)ethyl)carbamoyl)1Hpyrrolo(23b)quinoxalin1yl)imino)methyl)benzoate
840516441
COC(=O)C1=CC=C(C=C1)C=NN2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCCC5=CCCCC5)N
COC(=O)c1ccc(cc1)C=Nn1c2nc3ccccc3nc2c(c1N)C(=O)NCCC1=CCCCC1
InChI=1SC28H28N6O3c13728(36)20131119(121420)17313425(29)23(27(35)301615187324818)2426(34)33221065921(22)3224h5791417H248151629H21H3(H3035)b3117+
methyl4((E)((2amino3((2(cyclohex1en1yl)ethyl)carbamoyl)1Hpyrrolo(23b)quinoxalin1yl)imino)methyl)benzoate
METHYL4((E)(2AMINO3(2(CYCLOHEXEN1YL)ETHYLCARBAMOYL)PYRROLO(32B)QUINOXALIN1YL)IMINOMETHYL)BENZOATE
MFCD04010534
ZINC000002359136
ZINC2359134
Check stock
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Check stock on Vitas-MAvailable files
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