Vitas-M small molecule compound
3-{[5-(furan-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
Catalog ID
STK655359
SMILES O=C1Nc2ccccc2CCC1Sc1nnc(n1C)c1ccco1
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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 C17H16N4O2S MW 340.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O2S/c1-21-15(13-7-4-10-23-13)19-20-17(21)24-14-9-8-11-5-2-3-6-12(11)18-16(14)22/h2-7,10,14H,8-9H2,1H3,(H,18,22)InChIKey
MTUOYOHVMNSDLN-UHFFFAOYSA-NSynonyms
1040712-82-01040712820
3((5(furan2yl)4methyl124triazol3yl)sulfanyl)1345tetrahydro1benzazepin2one
3((5(furan2yl)4methyl4H124triazol3yl)sulfanyl)1345tetrahydro2H1benzazepin2one
3((5(furan2yl)4methyl4H124triazol3yl)thio)45dihydro1Hbenzo(b)azepin2(3H)one
CN1C(=NN=C1SC2CCC3=CC=CC=C3NC2=O)C4=CC=CO4
InChI=1SC17H16N4O2Sc12115(1374102313)192017(21)24149811523612(11)1816(14)22h271014H89H21H3(H1822)
MFCD12217581
ZINC000032103757
ZINC000032103759
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