Vitas-M small molecule compound
3-(pentylsulfanyl)-6-(2-propoxyphenyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Catalog ID
STK979943
SMILES CCCCCSc1nnc2c(n1)OC(Nc1c2cccc1)c1ccccc1OCCC
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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 C24H28N4O2S MW 436.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N4O2S/c1-3-5-10-16-31-24-26-23-21(27-28-24)17-11-6-8-13-19(17)25-22(30-23)18-12-7-9-14-20(18)29-15-4-2/h6-9,11-14,22,25H,3-5,10,15-16H2,1-2H3InChIKey
QMKJXACSRUTRRC-UHFFFAOYSA-NSynonyms
676590-60-63(pentylsulfanyl)6(2propoxyphenyl)67dihydro(124)triazino(56d)(31)benzoxazepine
3pentylsulfanyl6(2propoxyphenyl)67dihydro(124)triazino(56d)(31)benzoxazepine
676590606
CCCCCSC1=NC2=C(C3=CC=CC=C3NC(O2)C4=CC=CC=C4OCCC)N=N1
InChI=1SC24H28N4O2Sc13510163124262321(272824)1711681319(17)2522(3023)1812791420(18)291542h6911142225H35101516H212H3
MFCD01919496
ZINC000002742941
ZINC000002742942
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