Vitas-M small molecule compound

N-(4-nitrophenyl)-1,2-benzothiazol-3-amine 1,1-dioxide

Catalog ID
STK667414
SMILES [O-][N+](=O)c1ccc(cc1)NC1=NS(=O)(=O)c2c1cccc2

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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 C13H9N3O4S MW 303.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9N3O4S/c17-16(18)10-7-5-9(6-8-10)14-13-11-3-1-2-4-12(11)21(19,20)15-13/h1-8H,(H,14,15)
InChIKey
XJKCCKLAONFMIX-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1ccc(cc1)NC1=NS(=O)(=O)c2c1cccc2
3((4NITROPHENYL)AMINO)BENZO(D)12THIAZOLE11DIONE
C1=CC=C2C(=C1)C(=NS2(=O)=O)NC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC13H9N3O4Sc1716(18)10759(6810)141311312412(11)21(1920)1513h18H(H1415)
MFCD02110162
N(4NITROPHENYL)11DIOXO12BENZOTHIAZOL3AMINE
N(4NITROPHENYL)12BENZOTHIAZOL3AMINE11DIOXIDE
ZINC000004004759
ZINC04004759
ZINC4004759

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Available files

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