Vitas-M small molecule compound
4-[4-(4-cyanophenyl)-7-hydroxy-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoic acid
Catalog ID
STL315294
SMILES N#Cc1ccc(cc1)C1SCC(=Nc2c1cnn2c1ccc(cc1)C(=O)O)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 C20H14N4O3S MW 390.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N4O3S/c21-9-12-1-3-13(4-2-12)18-16-10-22-24(19(16)23-17(25)11-28-18)15-7-5-14(6-8-15)20(26)27/h1-8,10,18H,11H2,(H,23,25)(H,26,27)InChIKey
SQQLGLKIQDYHNS-UHFFFAOYSA-NSynonyms
1436003-45-01436003450
4(4(4cyanophenyl)7hydroxy46dihydro1Hpyrazolo(34e)(14)thiazepin1yl)benzoicacid
MFCD28027174
ZINC000095476962
ZINC000095476963
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