Vitas-M small molecule compound

N,N'-bis(1,1-dioxido-1,2-benzothiazol-3-yl)ethane-1,2-diamine

Catalog ID
STL290962
SMILES O=S1(=O)N=C(c2c1cccc2)NCCNC1=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 C16H14N4O4S2 MW 390.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N4O4S2/c21-25(22)13-7-3-1-5-11(13)15(19-25)17-9-10-18-16-12-6-2-4-8-14(12)26(23,24)20-16/h1-8H,9-10H2,(H,17,19)(H,18,20)
InChIKey
WAFOYJOIKYGOCI-UHFFFAOYSA-N
Synonyms

C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCNC3=NS(=O)(=O)C4=CC=CC=C43
InChI=1SC16H14N4O4S2c2125(22)13731511(13)15(1925)17910181612624814(12)26(2324)2016h18H910H2(H1719)(H1820)
MFCD01442096
NNbis(11dioxido12benzothiazol3yl)ethane12diamine
NNBIS(11DIOXO12BENZOTHIAZOL3YL)ETHANE12DIAMINE
ZINC000005685307
ZINC05685307
ZINC5685307

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Available files

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