Vitas-M small molecule compound
2-(4-ethyl-5-{[(4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-N-(2-methylphenyl)acetamide
Catalog ID
STK211581
SMILES CCn1c(SCc2nc3ccccc3c(=O)[nH]2)nnc1CC(=O)Nc1ccccc1C
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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 C22H22N6O2S MW 434.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O2S/c1-3-28-19(12-20(29)24-16-10-6-4-8-14(16)2)26-27-22(28)31-13-18-23-17-11-7-5-9-15(17)21(30)25-18/h4-11H,3,12-13H2,1-2H3,(H,24,29)(H,23,25,30)InChIKey
ITWHZRFWFBJPJU-UHFFFAOYSA-NSynonyms
2(4ETHYL5(((4OXO34DIHYDROQUINAZOLIN2YL)METHYL)SULFANYL)4H124TRIAZOL3YL)N(2METHYLPHENYL)ACETAMIDE
2(4ETHYL5((4OXO1HQUINAZOLIN2YL)METHYLSULFANYL)124TRIAZOL3YL)N(2METHYLPHENYL)ACETAMIDE
CCN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)CC(=O)NC4=CC=CC=C4C
CCn1c(SCc2nc3ccccc3c(=O)(nH)2)nnc1CC(=O)Nc1ccccc1C
InChI=1SC22H22N6O2Sc132819(1220(29)24161064814(16)2)262722(28)31131823171175915(17)21(30)2518h411H31213H212H3(H2429)(H232530)
MFCD07399370
ZINC000009262700
ZINC09262700
ZINC9262700
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