Vitas-M small molecule compound
2-amino-N-[2-(3,4-diethoxyphenyl)ethyl]-1-(4-fluorobenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Catalog ID
STL146053
SMILES CCOc1cc(CCNC(=O)c2c(N)n(c3c2nc2ccccc2n3)Cc2ccc(cc2)F)ccc1OCC
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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 C30H30FN5O3 MW 527.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30FN5O3/c1-3-38-24-14-11-19(17-25(24)39-4-2)15-16-33-30(37)26-27-29(35-23-8-6-5-7-22(23)34-27)36(28(26)32)18-20-9-12-21(31)13-10-20/h5-14,17H,3-4,15-16,18,32H2,1-2H3,(H,33,37)InChIKey
MXLIURSYVFLTCP-UHFFFAOYSA-NSynonyms
835912-44-22AMINON(2(34DIETHOXYPHENYL)ETHYL)1((4FLUOROPHENYL)METHYL)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
2aminoN(2(34diethoxyphenyl)ethyl)1(4fluorobenzyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2aminoN(34diethoxyphenethyl)1(4fluorobenzyl)1Hpyrrolo(23b)quinoxaline3carboxamide
835912442
CCOC1=C(C=C(C=C1)CCNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5=CC=C(C=C5)F)N)OCC
InChI=1SC30H30FN5O3c133824141119(1725(24)3942)15163330(37)262729(3523865722(23)3427)36(28(26)32)182091221(31)131020h51417H3415161832H212H3(H3337)
MFCD03687747
ZINC000002249974
ZINC02249974
ZINC2249974
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