Vitas-M small molecule compound

Catalog ID
STK568190
SMILES O=S(=O)(c1cccc2c1nsn2)/N=c/1\[nH]c2ccccc2nc1NCC1CCCO1

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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 C19H18N6O3S2 MW 442.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N6O3S2/c26-30(27,16-9-3-8-15-17(16)24-29-23-15)25-19-18(20-11-12-5-4-10-28-12)21-13-6-1-2-7-14(13)22-19/h1-3,6-9,12H,4-5,10-11H2,(H,20,21)(H,22,25)
InChIKey
SPGRJJQOFSIKPO-UHFFFAOYSA-N
Synonyms
1008035-64-0
1008035640
C1CC(OC1)CNC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=CC5=NSN=C54
InChI=1SC19H18N6O3S2c2630(27169381517(16)24292315)251918(20111254102812)2113612714(13)2219h136912H451011H2(H2021)(H2225)
MFCD05728693
N(3(((2R)TETRAHYDROFURAN2YLMETHYL)AMINO)QUINOXALIN2YL)213BENZOTHIADIAZOLE4SULFONAMIDE
N(3(oxolan2ylmethylamino)quinoxalin2yl)213benzothiadiazole4sulfonamide
N(3(OXOLAN2YLMETHYLAMINO)QUINOXALIN2YL)8
O=S(=O)(c1cccc2c1nsn2)N=c1(nH)c2ccccc2nc1NCC1CCCO1
ZINC000001826098
ZINC000001826100

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Available files

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