Vitas-M small molecule compound
4-[7-hydroxy-4-(propan-2-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoic acid
Catalog ID
STL313008
SMILES CC(C1SCC(=Nc2c1cnn2c1ccc(cc1)C(=O)O)O)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 C16H17N3O3S MW 331.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3O3S/c1-9(2)14-12-7-17-19(15(12)18-13(20)8-23-14)11-5-3-10(4-6-11)16(21)22/h3-7,9,14H,8H2,1-2H3,(H,18,20)(H,21,22)InChIKey
ZYPMIJQCHGALLP-UHFFFAOYSA-NSynonyms
1436002-10-61436002106
4(7hydroxy4(propan2yl)46dihydro1Hpyrazolo(34e)(14)thiazepin1yl)benzoicacid
MFCD28029862
ZINC000095475199
ZINC000095475200
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