Vitas-M small molecule compound
6-(3,4-dimethoxyphenyl)-3-(pentylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Catalog ID
STK979887
SMILES CCCCCSc1nnc2c(n1)OC(Nc1c2cccc1)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 C23H26N4O3S MW 438.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O3S/c1-4-5-8-13-31-23-25-22-20(26-27-23)16-9-6-7-10-17(16)24-21(30-22)15-11-12-18(28-2)19(14-15)29-3/h6-7,9-12,14,21,24H,4-5,8,13H2,1-3H3InChIKey
SRSWUSXJBXDDMO-UHFFFAOYSA-NSynonyms
6(34dimethoxyphenyl)3(pentylsulfanyl)67dihydro(124)triazino(56d)(31)benzoxazepine
6(34DIMETHOXYPHENYL)3PENTYLSULFANYL67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
CCCCCSC1=NC2=C(C3=CC=CC=C3NC(O2)C4=CC(=C(C=C4)OC)OC)N=N1
InChI=1SC23H26N4O3Sc1458133123252220(262723)169671017(16)2421(3022)15111218(282)19(1415)293h67912142124H45813H213H3
MFCD01647729
ZINC000002083914
ZINC000002083915
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