Vitas-M small molecule compound

4-(4-fluorophenyl)-7-hydroxy-1-(pentan-3-yl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one

Catalog ID
STL037529
SMILES CCC(n1[nH]c(=O)c2c1N=C(O)CSC2c1ccc(cc1)F)CC

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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 C17H20FN3O2S MW 349.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20FN3O2S/c1-3-12(4-2)21-16-14(17(23)20-21)15(24-9-13(22)19-16)10-5-7-11(18)8-6-10/h5-8,12,15H,3-4,9H2,1-2H3,(H,19,22)(H,20,23)
InChIKey
JRDHLCVIYKHMLC-UHFFFAOYSA-N
Synonyms
579441-31-9
4(4fluorophenyl)7hydroxy1(pentan3yl)1246tetrahydro3Hpyrazolo(34e)(14)thiazepin3one
579441319
CCC(n1(nH)c(=O)c2c1N=C(O)CSC2c1ccc(cc1)F)CC
MFCD04077138

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Available files

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