Vitas-M small molecule compound
4-[1-(4-fluorophenyl)-3,5-dimethyl-1H-pyrazol-4-yl]-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Catalog ID
STL311189
SMILES Fc1ccc(cc1)n1nc(c(c1C)C1SCC(=Nc2c1cn[nH]2)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 C17H16FN5OS MW 357.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16FN5OS/c1-9-15(10(2)23(22-9)12-5-3-11(18)4-6-12)16-13-7-19-21-17(13)20-14(24)8-25-16/h3-7,16H,8H2,1-2H3,(H2,19,20,21,24)InChIKey
OQRIPZLMBLJAJN-UHFFFAOYSA-NSynonyms
1401600-59-61401600596
4(1(4fluorophenyl)35dimethyl1Hpyrazol4yl)46dihydro1Hpyrazolo(34e)(14)thiazepin7ol
4(1(4fluorophenyl)35dimethylpyrazol4yl)24dihydro1Hpyrazolo(34e)(14)thiazepin7one
CC1=C(C(=NN1C2=CC=C(C=C2)F)C)C3C4=CNNC4=NC(=O)CS3
Fc1ccc(cc1)n1nc(c(c1C)C1SCC(=Nc2c1cn(nH)2)O)C
InChI=1SC17H16FN5OSc1915(10(2)23(229)125311(18)4612)16137192117(13)2014(24)82516h3716H8H212H3(H219202124)
MFCD28025961
ZINC000079484625
ZINC000079484629
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