Vitas-M small molecule compound

2,2'-[(methylimino)dipropane-3,1-diyl]bis[5-(3-nitrophenoxy)-1H-isoindole-1,3(2H)-dione]

Catalog ID
STK378372
SMILES CN(CCCN1C(=O)c2c(C1=O)cc(cc2)Oc1cccc(c1)[N+](=O)[O-])CCCN1C(=O)c2c(C1=O)cc(cc2)Oc1cccc(c1)[N+](=O)[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 C35H29N5O10 MW 679.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H29N5O10/c1-36(14-4-16-37-32(41)28-12-10-26(20-30(28)34(37)43)49-24-8-2-6-22(18-24)39(45)46)15-5-17-38-33(42)29-13-11-27(21-31(29)35(38)44)50-25-9-3-7-23(19-25)40(47)48/h2-3,6-13,18-21H,4-5,14-17H2,1H3
InChIKey
RZKJSPMCHNNFSG-UHFFFAOYSA-N
Synonyms

2(3(METHYL(3(5(3NITROPHENOXY)13DIOXOBENZO(C)AZOLIN2YL)PROPYL)AMINO)PROPYL)5(3NITROPHENOXY)BENZO(C)AZOLINE13DIONE
2(3(METHYL(3(5(3NITROPHENOXY)13DIOXOISOINDOL2YL)PROPYL)AMINO)PROPYL)5(3NITROPHENOXY)ISOINDOLE13DIONE
22((methylimino)dipropane31diyl)bis(5(3nitrophenoxy)1Hisoindole13(2H)dione)
CN(CCCN1C(=O)C2=C(C1=O)C=C(C=C2)OC3=CC=CC(=C3)(N+)(=O)(O))CCCN4C(=O)C5=C(C4=O)C=C(C=C5)OC6=CC=CC(=C6)(N+)(=O)(O)
CN(CCCN1C(=O)c2c(C1=O)cc(cc2)Oc1cccc(c1)(N+)(=O)(O))CCCN1C(=O)c2c(C1=O)cc(cc2)Oc1cccc(c1)(N+)(=O)(O)
InChI=1SC35H29N5O10c136(144163732(41)28121026(2030(28)34(37)43)492482622(1824)39(45)46)155173833(42)29131127(2131(29)35(38)44)502593723(1925)40(47)48h236131821H451417H21H3
MFCD01797685
ZINC000150357256
ZINC150357256

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Available files

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