Vitas-M small molecule compound
1-(4-acetylphenyl)-2-amino-N-(1,3-benzodioxol-5-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Catalog ID
STK533681
SMILES O=C(c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)C(=O)C)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 C27H21N5O4 MW 479.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N5O4/c1-15(33)17-7-9-18(10-8-17)32-25(28)23(24-26(32)31-20-5-3-2-4-19(20)30-24)27(34)29-13-16-6-11-21-22(12-16)36-14-35-21/h2-12H,13-14,28H2,1H3,(H,29,34)InChIKey
PPMQYTOBDXAFGX-UHFFFAOYSA-NSynonyms
1(4acetylphenyl)2aminoN(13benzodioxol5ylmethyl)1Hpyrrolo(23b)quinoxaline3carboxamide
1(4ACETYLPHENYL)2AMINON(13BENZODIOXOL5YLMETHYL)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
1(4acetylphenyl)2aminoN(benzo(d)(13)dioxol5ylmethyl)1Hpyrrolo(23b)quinoxaline3carboxamide
CC(=O)C1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC6=C(C=C5)OCO6)N
InChI=1SC27H21N5O4c115(33)177918(10817)3225(28)23(2426(32)3120532419(20)3024)27(34)2913166112122(1216)36143521h212H131428H21H3(H2934)
MFCD01960093
ZINC000002289781
ZINC02289781
ZINC2289781
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