Vitas-M small molecule compound

4,4'-[(3-oxo-1,3-dihydro-2-benzofuran-1,1-diyl)bis(benzene-4,1-diyloxy)]dibenzene-1,2-dicarbonitrile

Catalog ID
STK367074
SMILES N#Cc1ccc(cc1C#N)Oc1ccc(cc1)C1(OC(=O)c2c1cccc2)c1ccc(cc1)Oc1ccc(c(c1)C#N)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 C36H18N4O4 MW 570.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H18N4O4/c37-19-23-5-11-31(17-25(23)21-39)42-29-13-7-27(8-14-29)36(34-4-2-1-3-33(34)35(41)44-36)28-9-15-30(16-10-28)43-32-12-6-24(20-38)26(18-32)22-40/h1-18H
InChIKey
SRFJFXJGZQROGC-UHFFFAOYSA-N
Synonyms

33BIS(4(34DICYANOPHENOXY)PHENYL)13DIHYDROISOBENZOFURAN1ONE
4(4(1(4(34DICYANOPHENOXY)PHENYL)3OXO2BENZOFURAN1YL)PHENOXY)BENZENE12DICARBONITRILE
4(4(1(4(34DICYANOPHENOXY)PHENYL)3OXOHYDROISOBENZOFURANYL)PHENOXY)BENZENE12DICARBONITRILE
44((3oxo13dihydro2benzofuran11diyl)bis(benzene41diyloxy))dibenzene12dicarbonitrile
C1=CC=C2C(=C1)C(=O)OC2(C3=CC=C(C=C3)OC4=CC(=C(C=C4)C#N)C#N)C5=CC=C(C=C5)OC6=CC(=C(C=C6)C#N)C#N
InChI=1SC36H18N4O4c37192351131(1725(23)2139)422913727(81429)36(34421333(34)35(41)4436)2891530(161028)433212624(2038)26(1832)2240h118H
MFCD00318280
ZINC000004015784
ZINC4015784

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Available files

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