Vitas-M small molecule compound

2-amino-N-pentyl-1-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

Catalog ID
STL240254
SMILES CCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1ccc(cc1)C(C)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 C26H30N6O MW 442.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N6O/c1-4-5-8-15-28-26(33)22-23-25(31-21-10-7-6-9-20(21)30-23)32(24(22)27)29-16-18-11-13-19(14-12-18)17(2)3/h6-7,9-14,16-17H,4-5,8,15,27H2,1-3H3,(H,28,33)/b29-16+
InChIKey
MGAWLYYPIHYBDR-MUFRIFMGSA-N
Synonyms
835906-29-1
(E)2amino1((4isopropylbenzylidene)amino)Npentyl1Hpyrrolo(23b)quinoxaline3carboxamide
2aminoNpentyl1(((E)(4(propan2yl)phenyl)methylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINONPENTYL1((E)(4PROPAN2YLPHENYL)METHYLIDENEAMINO)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
835906291
CCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)N=CC4=CC=C(C=C4)C(C)C)N
CCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)N=Cc1ccc(cc1)C(C)C
InChI=1SC26H30N6Oc1458152826(33)222325(31211076920(21)3023)32(24(22)27)291618111319(141218)17(2)3h679141617H4581527H213H3(H2833)b2916+
MFCD03686324
ZINC000002247872
ZINC33351532

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Available files

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