Vitas-M small molecule compound
4-(2,1,3-benzothiadiazol-5-ylamino)-2-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-4-oxobutanoic acid
Catalog ID
STL244492
SMILES OCCN1CCN(CC1)CC(C(=O)O)CC(=O)Nc1ccc2c(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 C17H23N5O4S MW 393.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23N5O4S/c23-8-7-21-3-5-22(6-4-21)11-12(17(25)26)9-16(24)18-13-1-2-14-15(10-13)20-27-19-14/h1-2,10,12,23H,3-9,11H2,(H,18,24)(H,25,26)InChIKey
DDMWPFKFDJPRGL-UHFFFAOYSA-NSynonyms
1401568-74-81401568748
4(213benzothiadiazol5ylamino)2((4(2hydroxyethyl)piperazin1yl)methyl)4oxobutanoicacid
4(benzo(c)(125)thiadiazol5ylamino)2((4(2hydroxyethyl)piperazin1yl)methyl)4oxobutanoicacid
C1CN(CCN1CCO)CC(CC(=O)NC2=CC3=NSN=C3C=C2)C(=O)O
InChI=1SC17H23N5O4Sc2387213522(6421)1112(17(25)26)916(24)1813121415(1013)20271914h12101223H3911H2(H1824)(H2526)
MFCD22585569
ZINC000079493808
ZINC000079493811
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