Vitas-M small molecule compound
3-(propylsulfanyl)-6-(pyridin-4-yl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Catalog ID
STK791966
SMILES CCCSc1nnc2c(n1)OC(Nc1c2cccc1)c1ccncc1
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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 C18H17N5OS MW 351.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N5OS/c1-2-11-25-18-21-17-15(22-23-18)13-5-3-4-6-14(13)20-16(24-17)12-7-9-19-10-8-12/h3-10,16,20H,2,11H2,1H3InChIKey
XSZNSSDTJPULIH-UHFFFAOYSA-NSynonyms
3(propylsulfanyl)6(pyridin4yl)67dihydro(124)triazino(56d)(31)benzoxazepine
3PROPYLSULFANYL6PYRIDIN4YL67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
CCCSC1=NC2=C(C3=CC=CC=C3NC(O2)C4=CC=NC=C4)N=N1
InChI=1SC18H17N5OSc12112518211715(222318)13534614(13)2016(2417)12791910812h3101620H211H21H3
MFCD01019013
ZINC000002187931
ZINC000008628367
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