Vitas-M small molecule compound
6-(2-methoxyphenyl)-3-(pentylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Catalog ID
STK979924
SMILES CCCCCSc1nnc2c(n1)OC(Nc1c2cccc1)c1ccccc1OC
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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 C22H24N4O2S MW 408.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O2S/c1-3-4-9-14-29-22-24-21-19(25-26-22)15-10-5-7-12-17(15)23-20(28-21)16-11-6-8-13-18(16)27-2/h5-8,10-13,20,23H,3-4,9,14H2,1-2H3InChIKey
JRLDKYZJRZPCKY-UHFFFAOYSA-NSynonyms
352700-42-6352700426
6(2methoxyphenyl)3(pentylsulfanyl)67dihydro(124)triazino(56d)(31)benzoxazepine
6(2METHOXYPHENYL)3PENTYLSULFANYL67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
CCCCCSC1=NC2=C(C3=CC=CC=C3NC(O2)C4=CC=CC=C4OC)N=N1
InChI=1SC22H24N4O2Sc1349142922242119(252622)1510571217(15)2320(2821)1611681318(16)272h5810132023H34914H212H3
MFCD01647987
ZINC000002084916
ZINC000002084917
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