Vitas-M small molecule compound

2-amino-N-(1,3-benzodioxol-5-ylmethyl)-1-(4-methoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

Catalog ID
STK534796
SMILES COc1ccc(cc1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NCc1ccc2c(c1)OCO2

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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 C26H21N5O4 MW 467.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N5O4/c1-33-17-9-7-16(8-10-17)31-24(27)22(23-25(31)30-19-5-3-2-4-18(19)29-23)26(32)28-13-15-6-11-20-21(12-15)35-14-34-20/h2-12H,13-14,27H2,1H3,(H,28,32)
InChIKey
UMNVMCZRPRGUMR-UHFFFAOYSA-N
Synonyms
374099-00-0
2aminoN(13benzodioxol5ylmethyl)1(4methoxyphenyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINON(13BENZODIOXOL5YLMETHYL)1(4METHOXYPHENYL)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
2aminoN(benzo(d)(13)dioxol5ylmethyl)1(4methoxyphenyl)1Hpyrrolo(23b)quinoxaline3carboxamide
374099000
COC1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC6=C(C=C5)OCO6)N
InChI=1SC26H21N5O4c133179716(81017)3124(27)22(2325(31)3019532418(19)2923)26(32)2813156112021(1215)35143420h212H131427H21H3(H2832)
MFCD01952862
ZINC000002286112
ZINC02286112
ZINC2286112

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Available files

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