Vitas-M small molecule compound

Catalog ID
STK631880
SMILES CC(=O)Nc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]c2ccccc2nc1Nc1ccc2c(c1)nsn2

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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 C22H17N7O3S2 MW 491.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N7O3S2/c1-13(30)23-14-6-9-16(10-7-14)34(31,32)29-22-21(25-17-4-2-3-5-18(17)26-22)24-15-8-11-19-20(12-15)28-33-27-19/h2-12H,1H3,(H,23,30)(H,24,25)(H,26,29)
InChIKey
JZFPBLINSYTRPK-UHFFFAOYSA-N
Synonyms
1113053-83-0
1113053830
CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC5=NSN=C5C=C4
CC(=O)Nc1ccc(cc1)S(=O)(=O)N=c1(nH)c2ccccc2nc1Nc1ccc2c(c1)nsn2
InChI=1SC22H17N7O3S2c113(30)23146916(10714)34(3132)292221(2517423518(17)2622)24158111920(1215)28332719h212H1H3(H2330)(H2425)(H2629)
MFCD18159606
N(4((3(213BENZOTHIADIAZOL5YLAMINO)QUINOXALIN2YL)SULFAMOYL)PHENYL)ACETAMIDE
ZINC000003169384
ZINC03169384
ZINC3169384

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Available files

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