Vitas-M small molecule compound
2-[(2-hydroxy-4,5-dihydro-3H-1-benzazepin-3-yl)sulfanyl]-1-[4-(3-methoxyphenyl)piperazin-1-yl]ethanone
Catalog ID
STK635951
SMILES COc1cccc(c1)N1CCN(CC1)C(=O)CSC1CCc2c(N=C1O)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 C23H27N3O3S MW 425.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O3S/c1-29-19-7-4-6-18(15-19)25-11-13-26(14-12-25)22(27)16-30-21-10-9-17-5-2-3-8-20(17)24-23(21)28/h2-8,15,21H,9-14,16H2,1H3,(H,24,28)InChIKey
OMZAYQMNTYPWDV-UHFFFAOYSA-NSynonyms
1010886-45-91010886459
2((2hydroxy45dihydro3H1benzazepin3yl)sulfanyl)1(4(3methoxyphenyl)piperazin1yl)ethanone
3(2(4(3methoxyphenyl)piperazin1yl)2oxoethyl)sulfanyl1345tetrahydro1benzazepin2one
COC1=CC=CC(=C1)N2CCN(CC2)C(=O)CSC3CCC4=CC=CC=C4NC3=O
InChI=1SC23H27N3O3Sc1291974618(1519)25111326(141225)22(27)16302110917523820(17)2423(21)28h281521H91416H21H3(H2428)
MFCD18160907
ZINC000012324352
ZINC000012324353
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