Vitas-M small molecule compound
2-[7-acetyl-3-(ethylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl]-6-methylphenyl acetate
Catalog ID
STK521800
SMILES CCSc1nnc2c(n1)OC(N(c1c2cccc1)C(=O)C)c1cccc(c1OC(=O)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 C23H22N4O4S MW 450.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O4S/c1-5-32-23-24-21-19(25-26-23)16-10-6-7-12-18(16)27(14(3)28)22(31-21)17-11-8-9-13(2)20(17)30-15(4)29/h6-12,22H,5H2,1-4H3InChIKey
PZBKPSPEJXZFQV-UHFFFAOYSA-NSynonyms
(2(7ACETYL3ETHYLSULFANYL6H(124)TRIAZINO(56D)(31)BENZOXAZEPIN6YL)6METHYLPHENYL)ACETATE2(7acetyl3(ethylsulfanyl)67dihydro(124)triazino(56d)(31)benzoxazepin6yl)6methylphenylacetate
CCSC1=NC2=C(C3=CC=CC=C3N(C(O2)C4=C(C(=CC=C4)C)OC(=O)C)C(=O)C)N=N1
Registry IDs
MFCD02378209ZINC000001159615
ZINC000001159616
Check stock
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Check stock on Vitas-MAvailable files
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