Vitas-M small molecule compound
1-[6-(3,4-dimethoxyphenyl)-3-(methylsulfanyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]propan-1-one
Catalog ID
STK522076
SMILES CCC(=O)N1C(Oc2c(c3c1cccc3)nnc(n2)SC)c1ccc(c(c1)OC)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 C22H22N4O4S MW 438.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O4S/c1-5-18(27)26-15-9-7-6-8-14(15)19-20(23-22(31-4)25-24-19)30-21(26)13-10-11-16(28-2)17(12-13)29-3/h6-12,21H,5H2,1-4H3InChIKey
RHPAJSYXPFRIMQ-UHFFFAOYSA-NSynonyms
1(6(34dimethoxyphenyl)3(methylsulfanyl)(124)triazino(56d)(31)benzoxazepin7(6H)yl)propan1one
1(6(34DIMETHOXYPHENYL)3METHYLSULFANYL6H(124)TRIAZINO(56D)(31)BENZOXAZEPIN7YL)PROPAN1ONE
CCC(=O)N1C(OC2=C(C3=CC=CC=C31)N=NC(=N2)SC)C4=CC(=C(C=C4)OC)OC
InChI=1SC22H22N4O4Sc1518(27)2615976814(15)1920(2322(314)252419)3021(26)13101116(282)17(1213)293h61221H5H214H3
MFCD07188761
ZINC000003655218
ZINC000003655219
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Check stock on Vitas-MAvailable files
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