Vitas-M small molecule compound
1-cyclopentyl-7-hydroxy-4-(4-hydroxyphenyl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Catalog ID
STL311753
SMILES Oc1ccc(cc1)C1SCC(=Nc2c1c(=O)[nH]n2C1CCCC1)O
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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 C17H19N3O3S MW 345.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3O3S/c21-12-7-5-10(6-8-12)15-14-16(18-13(22)9-24-15)20(19-17(14)23)11-3-1-2-4-11/h5-8,11,15,21H,1-4,9H2,(H,18,22)(H,19,23)InChIKey
DBYFHWWTEPTWBC-UHFFFAOYSA-NSynonyms
1435975-75-91435975759
1cyclopentyl4(4hydroxyphenyl)48dihydro2Hpyrazolo(34e)(14)thiazepine37dione
1cyclopentyl7hydroxy4(4hydroxyphenyl)1246tetrahydro3Hpyrazolo(34e)(14)thiazepin3one
C1CCC(C1)N2C3=C(C(SCC(=O)N3)C4=CC=C(C=C4)O)C(=O)N2
InChI=1SC17H19N3O3Sc21127510(6812)151416(1813(22)92415)20(1917(14)23)11312411h58111521H149H2(H1822)(H1923)
MFCD28026272
Oc1ccc(cc1)C1SCC(=Nc2c1c(=O)(nH)n2C1CCCC1)O
ZINC000095474272
ZINC000095474273
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