Vitas-M small molecule compound

butyl 4-{2-amino-3-[(3-ethoxypropyl)carbamoyl]-1H-pyrrolo[2,3-b]quinoxalin-1-yl}benzoate

Catalog ID
STK990294
SMILES CCCCOC(=O)c1ccc(cc1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NCCCOCC

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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 C27H31N5O4 MW 489.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N5O4/c1-3-5-17-36-27(34)18-11-13-19(14-12-18)32-24(28)22(26(33)29-15-8-16-35-4-2)23-25(32)31-21-10-7-6-9-20(21)30-23/h6-7,9-14H,3-5,8,15-17,28H2,1-2H3,(H,29,33)
InChIKey
WVGMDVIRBBFZIN-UHFFFAOYSA-N
Synonyms
577787-64-5
577787645
butyl4(2amino3((3ethoxypropyl)carbamoyl)1Hpyrrolo(23b)quinoxalin1yl)benzoate
BUTYL4(2AMINO3(3ETHOXYPROPYLCARBAMOYL)PYRROLO(32B)QUINOXALIN1YL)BENZOATE
CCCCOC(=O)C1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCCCOCC)N
InChI=1SC27H31N5O4c135173627(34)18111319(141218)3224(28)22(26(33)29158163542)2325(32)31211076920(21)3023h67914H358151728H212H3(H2933)
MFCD04027037
ZINC000008836649
ZINC08836649
ZINC8836649

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Available files

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