Vitas-M small molecule compound
6-(4-methoxyphenyl)-3-(methylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Catalog ID
STK326152
SMILES COc1ccc(cc1)C1Nc2ccccc2c2c(O1)nc(SC)nn2
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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 C18H16N4O2S MW 352.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O2S/c1-23-12-9-7-11(8-10-12)16-19-14-6-4-3-5-13(14)15-17(24-16)20-18(25-2)22-21-15/h3-10,16,19H,1-2H3InChIKey
OJOPQRJVAGUSCM-UHFFFAOYSA-NSynonyms
6(4methoxyphenyl)3(methylsulfanyl)67dihydro(124)triazino(56d)(31)benzoxazepine
6(4METHOXYPHENYL)3METHYLSULFANYL67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
COC1=CC=C(C=C1)C2NC3=CC=CC=C3C4=C(O2)N=C(N=N4)SC
InChI=1SC18H16N4O2Sc123129711(81012)161914643513(14)1517(2416)2018(252)222115h3101619H12H3
MFCD00609082
ZINC000000816743
ZINC000000816745
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