Vitas-M small molecule compound
2-amino-N-[2-(cyclohex-1-en-1-yl)ethyl]-1-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Catalog ID
STK920745
SMILES COc1cc(ccc1OC)/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 C28H30N6O3 MW 498.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N6O3/c1-36-22-13-12-19(16-23(22)37-2)17-31-34-26(29)24(28(35)30-15-14-18-8-4-3-5-9-18)25-27(34)33-21-11-7-6-10-20(21)32-25/h6-8,10-13,16-17H,3-5,9,14-15,29H2,1-2H3,(H,30,35)/b31-17+InChIKey
CLFNMOARQKDWIJ-KBVAKVRCSA-NSynonyms
843619-98-7(E)2aminoN(2(cyclohex1en1yl)ethyl)1((34dimethoxybenzylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2aminoN(2(cyclohex1en1yl)ethyl)1(((E)(34dimethoxyphenyl)methylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINON(2(CYCLOHEXEN1YL)ETHYL)1((E)(34DIMETHOXYPHENYL)METHYLIDENEAMINO)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
843619987
COC1=C(C=C(C=C1)C=NN2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCCC5=CCCCC5)N)OC
COc1cc(ccc1OC)C=Nn1c2nc3ccccc3nc2c(c1N)C(=O)NCCC1=CCCCC1
InChI=1SC28H30N6O3c13622131219(1623(22)372)17313426(29)24(28(35)301514188435918)2527(34)332111761020(21)3225h6810131617H359141529H212H3(H3035)b3117+
MFCD04015382
ZINC000002427986
ZINC2427985
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