Vitas-M small molecule compound
1-[6-(2-butoxyphenyl)-3-(methylsulfanyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]propan-1-one
Catalog ID
STK521025
SMILES CCCCOc1ccccc1C1Oc2nc(SC)nnc2c2c(N1C(=O)CC)cccc2
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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 C24H26N4O3S MW 450.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N4O3S/c1-4-6-15-30-19-14-10-8-12-17(19)23-28(20(29)5-2)18-13-9-7-11-16(18)21-22(31-23)25-24(32-3)27-26-21/h7-14,23H,4-6,15H2,1-3H3InChIKey
KIKDWUZUCPFLSC-UHFFFAOYSA-NSynonyms
1(6(2butoxyphenyl)3(methylsulfanyl)(124)triazino(56d)(31)benzoxazepin7(6H)yl)propan1one
1(6(2BUTOXYPHENYL)3METHYLSULFANYL6H(124)TRIAZINO(56D)(31)BENZOXAZEPIN7YL)PROPAN1ONE
6(2BUTOXYPHENYL)3(METHYLSULFANYL)7PROPIONYL67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
CCCCOC1=CC=CC=C1C2N(C3=CC=CC=C3C4=C(O2)N=C(N=N4)SC)C(=O)CC
InChI=1SC24H26N4O3Sc146153019141081217(19)2328(20(29)52)1813971116(18)2122(3123)2524(323)272621h71423H4615H213H3
MFCD02376913
ZINC000002104483
ZINC000002104484
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