Vitas-M small molecule compound

[5-bromo-1-(naphthalen-2-ylmethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]propanedinitrile

Catalog ID
STK273140
SMILES N#CC(=C1C(=O)N(c2c1cc(Br)cc2)Cc1ccc2c(c1)cccc2)C#N

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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 C22H12BrN3O MW 414.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H12BrN3O/c23-18-7-8-20-19(10-18)21(17(11-24)12-25)22(27)26(20)13-14-5-6-15-3-1-2-4-16(15)9-14/h1-10H,13H2
InChIKey
ODAJSYLOWGVMTO-UHFFFAOYSA-N
Synonyms

(5BROMO1(2NAPHTHYLMETHYL)2OXOBENZO(D)AZOLIN3YLIDENE)METHANE11DICARBONITRILE
(5bromo1(naphthalen2ylmethyl)2oxo12dihydro3Hindol3ylidene)propanedinitrile
2(5BROMO1(NAPHTHALEN2YLMETHYL)2OXOINDOL3YLIDENE)PROPANEDINITRILE
C1=CC=C2C=C(C=CC2=C1)CN3C4=C(C=C(C=C4)Br)C(=C(C#N)C#N)C3=O
InChI=1SC22H12BrN3Oc2318782019(1018)21(17(1124)1225)22(27)26(20)13145615312416(15)914h110H13H2
MFCD05661873
ZINC000001320733
ZINC01320733
ZINC1320733

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Available files

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