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Vitas-M small molecule compound

N-[(E)-amino(1,3-benzoxazol-2-ylamino)methylidene]-2-nitrobenzamide

Catalog ID
STK035683
SMILES N/C(=N\C(=O)c1ccccc1[N+](=O)[O-])/Nc1nc2c(o1)cccc2

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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 C15H11N5O4 MW 325.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11N5O4/c16-14(19-15-17-10-6-2-4-8-12(10)24-15)18-13(21)9-5-1-3-7-11(9)20(22)23/h1-8H,(H3,16,17,18,19,21)
InChIKey
BLPPJXNRRZOTHY-UHFFFAOYSA-N
Synonyms
332144-05-5
(2E)3AMINO3(BENZOXAZOL2YLAMINO)1(2NITROPHENYL)2AZAPROP2EN1ONE
(E)N(amino(benzo(d)oxazol2ylamino)methylene)2nitrobenzamide
332144055
C1=CC=C(C(=C1)C(=O)NC(=NC2=NC3=CC=CC=C3O2)N)(N+)(=O)(O)
InChI=1SC15H11N5O4c1614(19151710624812(10)2415)1813(21)9513711(9)20(22)23h18H(H31617181921)
MFCD01796078
N((E)AMINO(13BENZOXAZOL2YLAMINO)METHYLIDENE)2NITROBENZAMIDE
N((E)N(13BENZOXAZOL2YL)CARBAMIMIDOYL)2NITROBENZAMIDE
N((Z)N(13BENZOXAZOL2YL)CARBAMIMIDOYL)2NITROBENZAMIDE
N(N(13BENZOXAZOL2YL)CARBAMIMIDOYL)2NITROBENZAMIDE
NBENZOOXAZOL2YLN(2NITROBENZOYL)GUANIDINE
NC(=NC(=O)c1ccccc1(N+)(=O)(O))Nc1nc2c(o1)cccc2
STK035683
ZINC000018323177
ZINC18323177

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.

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