Vitas-M small molecule compound
3-{[1-(3-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
Catalog ID
STK788314
SMILES COc1cccc(c1)n1nnnc1SC1CCc2c(NC1=O)cccc2
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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 C18H17N5O2S MW 367.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N5O2S/c1-25-14-7-4-6-13(11-14)23-18(20-21-22-23)26-16-10-9-12-5-2-3-8-15(12)19-17(16)24/h2-8,11,16H,9-10H2,1H3,(H,19,24)InChIKey
AUXZVFDUYGUIIA-UHFFFAOYSA-NSynonyms
1040695-14-41040695144
3((1(3methoxyphenyl)1Htetrazol5yl)sulfanyl)1345tetrahydro2H1benzazepin2one
3((1(3methoxyphenyl)1Htetrazol5yl)thio)45dihydro1Hbenzo(b)azepin2(3H)one
3(1(3methoxyphenyl)tetrazol5yl)sulfanyl1345tetrahydro1benzazepin2one
COC1=CC=CC(=C1)N2C(=NN=N2)SC3CCC4=CC=CC=C4NC3=O
InChI=1SC18H17N5O2Sc1251474613(1114)2318(20212223)261610912523815(12)1917(16)24h281116H910H21H3(H1924)
MFCD12210785
ZINC000032069533
ZINC000032069538
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