Vitas-M small molecule compound

heptyl 2-amino-1-[4-(butan-2-yl)phenyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate

Catalog ID
STK989826
SMILES CCCCCCCOC(=O)c1c2nc3ccccc3nc2n(c1N)c1ccc(cc1)C(CC)C

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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 C28H34N4O2 MW 458.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34N4O2/c1-4-6-7-8-11-18-34-28(33)24-25-27(31-23-13-10-9-12-22(23)30-25)32(26(24)29)21-16-14-20(15-17-21)19(3)5-2/h9-10,12-17,19H,4-8,11,18,29H2,1-3H3
InChIKey
AFYADUMJNOVIKH-UHFFFAOYSA-N
Synonyms
840497-86-1
840497861
CCCCCCCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)C(C)CC)N
heptyl2amino1(4(butan2yl)phenyl)1Hpyrrolo(23b)quinoxaline3carboxylate
heptyl2amino1(4(secbutyl)phenyl)1Hpyrrolo(23b)quinoxaline3carboxylate
HEPTYL2AMINO1(4BUTAN2YLPHENYL)PYRROLO(32B)QUINOXALINE3CARBOXYLATE
InChI=1SC28H34N4O2c1467811183428(33)242527(3123131091222(23)3025)32(26(24)29)21161420(151721)19(3)52h910121719H48111829H213H3
MFCD04008484
ZINC000097952677
ZINC000097952678

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Available files

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