Vitas-M small molecule compound
1,3-bis(butylsulfanyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Catalog ID
STK781496
SMILES CCCCSc1cc(SCCCC)c2c(c1)Oc1ccccc1NC2=O
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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 C21H25NO2S2 MW 387.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO2S2/c1-3-5-11-25-15-13-18-20(19(14-15)26-12-6-4-2)21(23)22-16-9-7-8-10-17(16)24-18/h7-10,13-14H,3-6,11-12H2,1-2H3,(H,22,23)InChIKey
QSBUPKKSWSEIGQ-UHFFFAOYSA-NSynonyms
13bis(butylsulfanyl)dibenzo(bf)(14)oxazepin11(10H)one
13DIBUTYLTHIO10HDIBENZO(BF)14OXAZEPIN11ONE
79BIS(BUTYLSULFANYL)5HBENZO(B)(14)BENZOXAZEPIN6ONE
CCCCSC1=CC(=C2C(=C1)OC3=CC=CC=C3NC2=O)SCCCC
InChI=1SC21H25NO2S2c135112515131820(19(1415)2612642)21(23)22169781017(16)2418h7101314H361112H212H3(H2223)
MFCD06015187
ZINC000004721908
ZINC04721908
ZINC4721908
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