Vitas-M small molecule compound
3-{[4-methyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
Catalog ID
STL240163
SMILES O=C1Nc2ccccc2CCC1Sc1nnc(n1C)c1cccnc1
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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/c1-23-16(13-6-4-10-19-11-13)21-22-18(23)25-15-9-8-12-5-2-3-7-14(12)20-17(15)24/h2-7,10-11,15H,8-9H2,1H3,(H,20,24)InChIKey
SQHUUFDLUJLAOQ-UHFFFAOYSA-NSynonyms
1040713-97-01040713970
3((4methyl5(pyridin3yl)4H124triazol3yl)sulfanyl)1345tetrahydro2H1benzazepin2one
3((4methyl5(pyridin3yl)4H124triazol3yl)thio)45dihydro1Hbenzo(b)azepin2(3H)one
3((4methyl5pyridin3yl124triazol3yl)sulfanyl)1345tetrahydro1benzazepin2one
CN1C(=NN=C1SC2CCC3=CC=CC=C3NC2=O)C4=CN=CC=C4
InChI=1SC18H17N5OSc12316(136410191113)212218(23)25159812523714(12)2017(15)24h27101115H89H21H3(H2024)
MFCD12206007
ZINC000020719440
ZINC000020719443
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