Vitas-M small molecule compound

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

Catalog ID
STK532801
SMILES Cc1cccc(c1C)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 C27H23N5O3 MW 465.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N5O3/c1-15-6-5-9-20(16(15)2)32-25(28)23(24-26(32)31-19-8-4-3-7-18(19)30-24)27(33)29-13-17-10-11-21-22(12-17)35-14-34-21/h3-12H,13-14,28H2,1-2H3,(H,29,33)
InChIKey
LEJHBGCGPFOTRN-UHFFFAOYSA-N
Synonyms

2aminoN(13benzodioxol5ylmethyl)1(23dimethylphenyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINON(13BENZODIOXOL5YLMETHYL)1(23DIMETHYLPHENYL)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
2aminoN(benzo(d)(13)dioxol5ylmethyl)1(23dimethylphenyl)1Hpyrrolo(23b)quinoxaline3carboxamide
CC1=C(C(=CC=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC6=C(C=C5)OCO6)N)C
InChI=1SC27H23N5O3c11565920(16(15)2)3225(28)23(2426(32)3119843718(19)3024)27(33)29131710112122(1217)35143421h312H131428H212H3(H2933)
MFCD02164076
ZINC000002291500
ZINC02291500
ZINC2291500

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Available files

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