Vitas-M small molecule compound
ethyl [4-(1,5-dimethyl-1H-pyrazol-4-yl)-7-hydroxy-3-methyl-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]acetate
Catalog ID
STL312404
SMILES CCOC(=O)Cn1nc(c2c1N=C(O)CSC2c1cnn(c1C)C)C
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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 C16H21N5O3S MW 363.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N5O3S/c1-5-24-13(23)7-21-16-14(9(2)19-21)15(25-8-12(22)18-16)11-6-17-20(4)10(11)3/h6,15H,5,7-8H2,1-4H3,(H,18,22)InChIKey
IPNNTHCVDHUHPJ-UHFFFAOYSA-NSynonyms
1401568-28-21401568282
ethyl(4(15dimethyl1Hpyrazol4yl)7hydroxy3methyl46dihydro1Hpyrazolo(34e)(14)thiazepin1yl)acetate
MFCD28026633
ZINC000095474764
ZINC000095474765
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