Vitas-M small molecule compound
1-[3-(methylsulfanyl)-6-(2,4,6-trimethoxyphenyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]propan-1-one
Catalog ID
STK521227
SMILES CCC(=O)N1C(Oc2c(c3c1cccc3)nnc(n2)SC)c1c(OC)cc(cc1OC)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 C23H24N4O5S MW 468.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O5S/c1-6-18(28)27-15-10-8-7-9-14(15)20-21(24-23(33-5)26-25-20)32-22(27)19-16(30-3)11-13(29-2)12-17(19)31-4/h7-12,22H,6H2,1-5H3InChIKey
TUNSGGKPEGXHGD-UHFFFAOYSA-NSynonyms
1(3(methylsulfanyl)6(246trimethoxyphenyl)(124)triazino(56d)(31)benzoxazepin7(6H)yl)propan1one
1(3METHYLSULFANYL6(246TRIMETHOXYPHENYL)6H(124)TRIAZINO(56D)(31)BENZOXAZEPIN7YL)PROPAN1ONE
3(METHYLSULFANYL)7PROPIONYL6(246TRIMETHOXYPHENYL)67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
CCC(=O)N1C(OC2=C(C3=CC=CC=C31)N=NC(=N2)SC)C4=C(C=C(C=C4OC)OC)OC
InChI=1SC23H24N4O5Sc1618(28)27151087914(15)2021(2423(335)262520)3222(27)1916(303)1113(292)1217(19)314h71222H6H215H3
MFCD03080413
ZINC000000684567
ZINC000000684568
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