Vitas-M small molecule compound

N-[(E)-amino(1,3-benzoxazol-2-ylamino)methylidene]-2-chloro-5-nitrobenzamide

Catalog ID
STK068734
SMILES N/C(=N\C(=O)c1cc(ccc1Cl)[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 C15H10ClN5O4 MW 359.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H10ClN5O4/c16-10-6-5-8(21(23)24)7-9(10)13(22)19-14(17)20-15-18-11-3-1-2-4-12(11)25-15/h1-7H,(H3,17,18,19,20,22)
InChIKey
HYVMTAGLPAJMOI-UHFFFAOYSA-N
Synonyms

(2E)3AMINO3(BENZOXAZOL2YLAMINO)1(2CHLORO5NITROPHENYL)2AZAPROP2EN1ONE
(E)N(amino(benzo(d)oxazol2ylamino)methylene)2chloro5nitrobenzamide
C1=CC=C2C(=C1)N=C(O2)N=C(N)NC(=O)C3=C(C=CC(=C3)(N+)(=O)(O))Cl
InChI=1SC15H10ClN5O4c1610658(21(23)24)79(10)13(22)1914(17)20151811312412(11)2515h17H(H31718192022)
MFCD02817135
N((E)AMINO(13BENZOXAZOL2YLAMINO)METHYLIDENE)2CHLORO5NITROBENZAMIDE
N((E)N(13benzoxazol2yl)carbamimidoyl)2chloro5nitrobenzamide
N(N(13BENZOXAZOL2YL)CARBAMIMIDOYL)2CHLORO5NITROBENZAMIDE
NC(=NC(=O)c1cc(ccc1Cl)(N+)(=O)(O))Nc1nc2c(o1)cccc2
STK068734
ZINC000002284659
ZINC2284659

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Available files

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