Vitas-M small molecule compound
1-(4-benzylpiperazin-1-yl)-2-[(2-hydroxy-4,5-dihydro-3H-1-benzazepin-3-yl)sulfanyl]ethanone
Catalog ID
STK635005
SMILES OC1=Nc2ccccc2CCC1SCC(=O)N1CCN(CC1)Cc1ccccc1
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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 C23H27N3O2S MW 409.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O2S/c27-22(26-14-12-25(13-15-26)16-18-6-2-1-3-7-18)17-29-21-11-10-19-8-4-5-9-20(19)24-23(21)28/h1-9,21H,10-17H2,(H,24,28)InChIKey
KXWODQUFHKBJMF-UHFFFAOYSA-NSynonyms
1081129-32-91(4benzylpiperazin1yl)2((2hydroxy45dihydro3H1benzazepin3yl)sulfanyl)ethanone
1081129329
3(2(4benzylpiperazin1yl)2oxoethyl)sulfanyl1345tetrahydro1benzazepin2one
C1CC2=CC=CC=C2NC(=O)C1SCC(=O)N3CCN(CC3)CC4=CC=CC=C4
InChI=1SC23H27N3O2Sc2722(26141225(131526)16186213718)172921111019845920(19)2423(21)28h1921H1017H2(H2428)
MFCD18160577
ZINC000020730255
ZINC000020730258
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