Vitas-M small molecule compound
4-(1,3-dimethyl-1H-pyrazol-4-yl)-3-methyl-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Catalog ID
STK934909
SMILES Cn1nc(c(c1)C1SCC(=Nc2c1c(C)n[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 C12H15N5OS MW 277.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15N5OS/c1-6-8(4-17(3)16-6)11-10-7(2)14-15-12(10)13-9(18)5-19-11/h4,11H,5H2,1-3H3,(H2,13,14,15,18)InChIKey
MPLOHUPBBPDDFL-UHFFFAOYSA-NSynonyms
1224169-39-41224169394
4(13dimethyl1Hpyrazol4yl)3methyl46dihydro1Hpyrazolo(34e)(14)thiazepin7ol
4(13dimethylpyrazol4yl)3methyl24dihydro1Hpyrazolo(34e)(14)thiazepin7one
CC1=C2C(SCC(=O)N=C2NN1)C3=CN(N=C3C)C
Cn1nc(c(c1)C1SCC(=Nc2c1c(C)n(nH)2)O)C
InChI=1SC12H15N5OSc168(417(3)166)11107(2)141512(10)139(18)51911h411H5H213H3(H213141518)
MFCD18177911
ZINC000044900973
ZINC000044900975
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