Vitas-M small molecule compound

2-amino-N-(2-phenylethyl)-1-{[(E)-(3,4,5-trimethoxyphenyl)methylidene]amino}-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

Catalog ID
STK714486
SMILES COc1cc(/C=N/n2c3nc4ccccc4nc3c(c2N)C(=O)NCCc2ccccc2)cc(c1OC)OC

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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 C29H28N6O4 MW 524.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N6O4/c1-37-22-15-19(16-23(38-2)26(22)39-3)17-32-35-27(30)24(29(36)31-14-13-18-9-5-4-6-10-18)25-28(35)34-21-12-8-7-11-20(21)33-25/h4-12,15-17H,13-14,30H2,1-3H3,(H,31,36)/b32-17+
InChIKey
GGUVBUDPCPOANP-VTNSRFBWSA-N
Synonyms
799835-88-4
(E)2aminoNphenethyl1((345trimethoxybenzylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2aminoN(2phenylethyl)1(((E)(345trimethoxyphenyl)methylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2aminoN(2phenylethyl)1((E)(345trimethoxyphenyl)methylideneamino)pyrrolo(32b)quinoxaline3carboxamide
2AMINONPHENETHYL1((E)(345TRIMETHOXYPHENYL)METHYLIDENEAMINO)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
799835884
COC1=CC(=CC(=C1OC)OC)C=NN2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCCC5=CC=CC=C5)N
COc1cc(C=Nn2c3nc4ccccc4nc3c(c2N)C(=O)NCCc2ccccc2)cc(c1OC)OC
InChI=1SC29H28N6O4c137221519(1623(382)26(22)393)17323527(30)24(29(36)3114131895461018)2528(35)342112871120(21)3325h4121517H131430H213H3(H3136)b3217+
MFCD03685192
ZINC000002246817
ZINC2246816

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Available files

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