Vitas-M small molecule compound
7-hydroxy-4-(3-hydroxy-4-methoxyphenyl)-1-(propan-2-yl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Catalog ID
STL313427
SMILES COc1ccc(cc1O)C1SCC(=Nc2c1c(=O)[nH]n2C(C)C)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 C16H19N3O4S MW 349.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N3O4S/c1-8(2)19-15-13(16(22)18-19)14(24-7-12(21)17-15)9-4-5-11(23-3)10(20)6-9/h4-6,8,14,20H,7H2,1-3H3,(H,17,21)(H,18,22)InChIKey
ILEXVGUKHBMMAO-UHFFFAOYSA-NSynonyms
1435984-50-14(3hydroxy4methoxyphenyl)1propan2yl48dihydro2Hpyrazolo(34e)(14)thiazepine37dione
7hydroxy4(3hydroxy4methoxyphenyl)1(propan2yl)1246tetrahydro3Hpyrazolo(34e)(14)thiazepin3one
CC(C)N1C2=C(C(SCC(=O)N2)C3=CC(=C(C=C3)OC)O)C(=O)N1
COc1ccc(cc1O)C1SCC(=Nc2c1c(=O)(nH)n2C(C)C)O
Registry IDs
MFCD28030105ZINC000095475543
ZINC000095475544
Check stock
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Check stock on Vitas-MAvailable files
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