Vitas-M small molecule compound

2-(4-tert-butylphenyl)-N-{(E)-[4-(2,4-dinitrophenoxy)phenyl]methylidene}-1,3-benzoxazol-5-amine

Catalog ID
STK668792
SMILES [O-][N+](=O)c1cc(ccc1Oc1ccc(cc1)/C=N/c1ccc2c(c1)nc(o2)c1ccc(cc1)C(C)(C)C)[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 C30H24N4O6 MW 536.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24N4O6/c1-30(2,3)21-8-6-20(7-9-21)29-32-25-16-22(10-14-27(25)40-29)31-18-19-4-12-24(13-5-19)39-28-15-11-23(33(35)36)17-26(28)34(37)38/h4-18H,1-3H3/b31-18+
InChIKey
FLHXNQCIKHYLIA-FDAWAROLSA-N
Synonyms

(O)(N+)(=O)c1cc(ccc1Oc1ccc(cc1)C=Nc1ccc2c(c1)nc(o2)c1ccc(cc1)C(C)(C)C)(N+)(=O)(O)
2(4tertbutylphenyl)N((E)(4(24dinitrophenoxy)phenyl)methylidene)13benzoxazol5amine
MFCD00733009
ZINC000003080004

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Available files

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