Vitas-M small molecule compound
N-(2-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-1-methyl-1H-benzimidazol-5-yl)-2,1,3-benzothiadiazole-4-sulfonamide
Catalog ID
STK641718
SMILES Cc1cc(C)nc(n1)SCc1nc2c(n1C)ccc(c2)NS(=O)(=O)c1cccc2c1nsn2
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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 C21H19N7O2S3 MW 497.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N7O2S3/c1-12-9-13(2)23-21(22-12)31-11-19-24-16-10-14(7-8-17(16)28(19)3)27-33(29,30)18-6-4-5-15-20(18)26-32-25-15/h4-10,27H,11H2,1-3H3InChIKey
AWQOEQVWKIOOHC-UHFFFAOYSA-NSynonyms
1010900-48-71010900487
CC1=CC(=NC(=N1)SCC2=NC3=C(N2C)C=CC(=C3)NS(=O)(=O)C4=CC=CC5=NSN=C54)C
InChI=1SC21H19N7O2S3c112913(2)2321(2212)31111924161014(7817(16)28(19)3)2733(2930)186451520(18)26322515h41027H11H213H3
MFCD12204182
N(2(((46dimethylpyrimidin2yl)sulfanyl)methyl)1methyl1Hbenzimidazol5yl)213benzothiadiazole4sulfonamide
N(2(((46dimethylpyrimidin2yl)thio)methyl)1methyl1Hbenzo(d)imidazol5yl)benzo(c)(125)thiadiazole4sulfonamide
N(2((46dimethylpyrimidin2yl)sulfanylmethyl)1methylbenzimidazol5yl)213benzothiadiazole4sulfonamide
ZINC000012323988
ZINC12323988
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