Vitas-M small molecule compound
2-[7-acetyl-3-(propylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl]-6-methoxyphenyl acetate
Catalog ID
STK521901
SMILES CCCSc1nnc2c(n1)OC(N(c1c2cccc1)C(=O)C)c1cccc(c1OC(=O)C)OC
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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 C24H24N4O5S MW 480.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N4O5S/c1-5-13-34-24-25-22-20(26-27-24)16-9-6-7-11-18(16)28(14(2)29)23(33-22)17-10-8-12-19(31-4)21(17)32-15(3)30/h6-12,23H,5,13H2,1-4H3InChIKey
GIXBDZLLTCDMPN-UHFFFAOYSA-NSynonyms
(2(7ACETYL3PROPYLSULFANYL6H(124)TRIAZINO(56D)(31)BENZOXAZEPIN6YL)6METHOXYPHENYL)ACETATE
2(7acetyl3(propylsulfanyl)67dihydro(124)triazino(56d)(31)benzoxazepin6yl)6methoxyphenylacetate
CCCSC1=NC2=C(C3=CC=CC=C3N(C(O2)C4=C(C(=CC=C4)OC)OC(=O)C)C(=O)C)N=N1
InChI=1SC24H24N4O5Sc15133424252220(262724)169671118(16)28(14(2)29)23(3322)171081219(314)21(17)3215(3)30h61223H513H214H3
MFCD03717698
ZINC000002822758
ZINC000002822759
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