Vitas-M small molecule compound

2-amino-1-{[(E)-(4-chlorophenyl)methylidene]amino}-N-(prop-2-en-1-yl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

Catalog ID
STK920739
SMILES C=CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1ccc(cc1)Cl

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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 C21H17ClN6O MW 404.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN6O/c1-2-11-24-21(29)17-18-20(27-16-6-4-3-5-15(16)26-18)28(19(17)23)25-12-13-7-9-14(22)10-8-13/h2-10,12H,1,11,23H2,(H,24,29)/b25-12+
InChIKey
IMSRMBMBXBARRN-BRJLIKDPSA-N
Synonyms
577989-86-7
(E)Nallyl2amino1((4chlorobenzylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1(((E)(4chlorophenyl)methylidene)amino)N(prop2en1yl)1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINO1((E)(4CHLOROPHENYL)METHYLIDENEAMINO)NPROP2ENYLPYRROLO(32B)QUINOXALINE3CARBOXAMIDE
577989867
C=CCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)N=CC4=CC=C(C=C4)Cl)N
C=CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)N=Cc1ccc(cc1)Cl
InChI=1SC21H17ClN6Oc12112421(29)171820(2716643515(16)2618)28(19(17)23)2512137914(22)10813h21012H11123H2(H2429)b2512+
MFCD04022346
ZINC000002349487
ZINC4475167

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Available files

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