Vitas-M small molecule compound

2-amino-1-{[(E)-(4-fluorophenyl)methylidene]amino}-N-heptyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

Catalog ID
STK990857
SMILES CCCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1ccc(cc1)F

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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 C25H27FN6O MW 446.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27FN6O/c1-2-3-4-5-8-15-28-25(33)21-22-24(31-20-10-7-6-9-19(20)30-22)32(23(21)27)29-16-17-11-13-18(26)14-12-17/h6-7,9-14,16H,2-5,8,15,27H2,1H3,(H,28,33)/b29-16+
InChIKey
FJMZSQLGFVIZKU-MUFRIFMGSA-N
Synonyms
573974-73-9
(E)2amino1((4fluorobenzylidene)amino)Nheptyl1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1(((E)(4fluorophenyl)methylidene)amino)Nheptyl1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINO1((E)(4FLUOROPHENYL)METHYLIDENEAMINO)NHEPTYLPYRROLO(32B)QUINOXALINE3CARBOXAMIDE
573974739
CCCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)N=CC4=CC=C(C=C4)F)N
CCCCCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)N=Cc1ccc(cc1)F
InChI=1SC25H27FN6Oc123458152825(33)212224(31201076919(20)3022)32(23(21)27)291617111318(26)141217h6791416H2581527H21H3(H2833)b2916+
MFCD04023340
ZINC000002368642
ZINC102983870

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Available files

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