Vitas-M small molecule compound
9-methoxy-4-[3-(methylsulfanyl)phenyl]-4,5-dihydro-1,4-benzoxazepin-3(2H)-one
Catalog ID
STL130278
SMILES CSc1cccc(c1)N1Cc2cccc(c2OCC1=O)OC
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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 C17H17NO3S MW 315.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO3S/c1-20-15-8-3-5-12-10-18(16(19)11-21-17(12)15)13-6-4-7-14(9-13)22-2/h3-9H,10-11H2,1-2H3InChIKey
HIGGOZPFGFEKJX-UHFFFAOYSA-NSynonyms
1326851-97-11326851971
9methoxy4(3(methylsulfanyl)phenyl)45dihydro14benzoxazepin3(2H)one
9methoxy4(3methylsulfanylphenyl)5H14benzoxazepin3one
COC1=CC=CC2=C1OCC(=O)N(C2)C3=CC(=CC=C3)SC
InChI=1SC17H17NO3Sc12015835121018(16(19)112117(12)15)1364714(913)222h39H1011H212H3
MFCD20749710
ZINC000067323813
ZINC67323813
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