Vitas-M small molecule compound
3-(butylsulfanyl)-6-(2,3,4-trimethoxyphenyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Catalog ID
STK327399
SMILES CCCCSc1nnc2c(n1)OC(Nc1c2cccc1)c1ccc(c(c1OC)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 C23H26N4O4S MW 454.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O4S/c1-5-6-13-32-23-25-22-18(26-27-23)14-9-7-8-10-16(14)24-21(31-22)15-11-12-17(28-2)20(30-4)19(15)29-3/h7-12,21,24H,5-6,13H2,1-4H3InChIKey
DQHIMURXEAHQOP-UHFFFAOYSA-NSynonyms
5672-16-23(butylsulfanyl)6(234trimethoxyphenyl)67dihydro(124)triazino(56d)(31)benzoxazepine
3BUTYLSULFANYL6(234TRIMETHOXYPHENYL)67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
5672162
CCCCSC1=NC2=C(C3=CC=CC=C3NC(O2)C4=C(C(=C(C=C4)OC)OC)OC)N=N1
InChI=1SC23H26N4O4Sc156133223252218(262723)149781016(14)2421(3122)15111217(282)20(304)19(15)293h7122124H5613H214H3
MFCD01470768
ZINC000002915864
ZINC000002915865
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