Vitas-M small molecule compound

pentyl 2-amino-1-[3-(ethoxycarbonyl)phenyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate

Catalog ID
STK919982
SMILES CCCCCOC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cccc(c1)C(=O)OCC

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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 C25H26N4O4 MW 446.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O4/c1-3-5-8-14-33-25(31)20-21-23(28-19-13-7-6-12-18(19)27-21)29(22(20)26)17-11-9-10-16(15-17)24(30)32-4-2/h6-7,9-13,15H,3-5,8,14,26H2,1-2H3
InChIKey
YTHMPSDVYPGWCC-UHFFFAOYSA-N
Synonyms
844826-63-7
844826637
CCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=CC(=C4)C(=O)OCC)N
InChI=1SC25H26N4O4c1358143325(31)202123(281913761218(19)2721)29(22(20)26)171191016(1517)24(30)3242h6791315H3581426H212H3
MFCD04161380
pentyl2amino1(3(ethoxycarbonyl)phenyl)1Hpyrrolo(23b)quinoxaline3carboxylate
PENTYL2AMINO1(3ETHOXYCARBONYLPHENYL)PYRROLO(32B)QUINOXALINE3CARBOXYLATE
ZINC000002406445
ZINC02406445
ZINC2406445

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Available files

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