Vitas-M small molecule compound
(2E)-2-[(4-oxo-4-{[4-(1H-1,2,4-triazol-1-ylmethyl)phenyl]amino}butanoyl)imino]-5-(propan-2-yl)-2,3-dihydro-1,3-thiazole-4-carboxylic acid
Catalog ID
STL315033
SMILES O=C(Nc1ccc(cc1)Cn1cncn1)CCC(=O)/N=c\1/sc(c([nH]1)C(=O)O)C(C)C
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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 C20H22N6O4S MW 442.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N6O4S/c1-12(2)18-17(19(29)30)25-20(31-18)24-16(28)8-7-15(27)23-14-5-3-13(4-6-14)9-26-11-21-10-22-26/h3-6,10-12H,7-9H2,1-2H3,(H,23,27)(H,29,30)(H,24,25,28)InChIKey
KUNBNUKVIMNGIR-UHFFFAOYSA-NSynonyms
1435999-61-3(2E)2((4oxo4((4(1H124triazol1ylmethyl)phenyl)amino)butanoyl)imino)5(propan2yl)23dihydro13thiazole4carboxylicacid
1435999613
MFCD28027027
O=C(Nc1ccc(cc1)Cn1cncn1)CCC(=O)N=c1sc(c((nH)1)C(=O)O)C(C)C
ZINC000095476776
ZINC95476776
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