Vitas-M small molecule compound

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

Catalog ID
STL032887
SMILES C=CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1cccc(c1)O

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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 C21H18N6O2 MW 386.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N6O2/c1-2-10-23-21(29)17-18-20(26-16-9-4-3-8-15(16)25-18)27(19(17)22)24-12-13-6-5-7-14(28)11-13/h2-9,11-12,28H,1,10,22H2,(H,23,29)/b24-12+
InChIKey
KCVWYKXZWONKLH-WYMPLXKRSA-N
Synonyms
586997-54-8
(E)Nallyl2amino1((3hydroxybenzylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1(((E)(3hydroxyphenyl)methylidene)amino)N(prop2en1yl)1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINO1((E)(3HYDROXYPHENYL)METHYLIDENEAMINO)NPROP2ENYLPYRROLO(32B)QUINOXALINE3CARBOXAMIDE
586997548
C=CCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)N=CC4=CC(=CC=C4)O)N
C=CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)N=Cc1cccc(c1)O
InChI=1SC21H18N6O2c12102321(29)171820(2616943815(16)2518)27(19(17)22)24121365714(28)1113h29111228H11022H2(H2329)b2412+
MFCD04031291
ZINC000001884956
ZINC33345801

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Available files

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