Vitas-M small molecule compound

4-[4-(pentyloxy)phenyl]-1,3-diphenyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one

Catalog ID
STK544279
SMILES CCCCCOc1ccc(cc1)C1SCC(=O)Nc2c1c(nn2c1ccccc1)c1ccccc1

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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 C29H29N3O2S MW 483.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O2S/c1-2-3-10-19-34-24-17-15-22(16-18-24)28-26-27(21-11-6-4-7-12-21)31-32(23-13-8-5-9-14-23)29(26)30-25(33)20-35-28/h4-9,11-18,28H,2-3,10,19-20H2,1H3,(H,30,33)
InChIKey
YJRFNOHJTNEVBH-UHFFFAOYSA-N
Synonyms
497229-99-9
4(4(pentyloxy)phenyl)13diphenyl48dihydro1Hpyrazolo(34e)(14)thiazepin7(6H)one
4(4(pentyloxy)phenyl)13diphenyl68dihydro1Hpyrazolo(34e)(14)thiazepin7(4H)one
497229999
MFCD03300550
ZINC000001761885
ZINC000001761887

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Available files

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