Vitas-M small molecule compound
3-{[4-methyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
Catalog ID
STL241532
SMILES O=C1Nc2ccccc2CCC1Sc1nnc(n1C)c1cccs1
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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 C17H16N4OS2 MW 356.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4OS2/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
MIOQHAZZSHHBHP-UHFFFAOYSA-NSynonyms
1040701-82-31040701823
3((4methyl5(thiophen2yl)4H124triazol3yl)sulfanyl)1345tetrahydro2H1benzazepin2one
3((4methyl5(thiophen2yl)4H124triazol3yl)thio)45dihydro1Hbenzo(b)azepin2(3H)one
3((4methyl5thiophen2yl124triazol3yl)sulfanyl)1345tetrahydro1benzazepin2one
CN1C(=NN=C1SC2CCC3=CC=CC=C3NC2=O)C4=CC=CS4
InChI=1SC17H16N4OS2c12115(1374102313)192017(21)24149811523612(11)1816(14)22h271014H89H21H3(H1822)
MFCD12207677
ZINC000020729040
ZINC000020729043
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