Vitas-M small molecule compound
2-[3-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-N-(4-methylphenyl)hydrazinecarbothioamide
Catalog ID
STL395996
SMILES O=C(CCn1nc(c(c1C)Br)C)NNC(=S)Nc1ccc(cc1)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 C16H20BrN5OS MW 410.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20BrN5OS/c1-10-4-6-13(7-5-10)18-16(24)20-19-14(23)8-9-22-12(3)15(17)11(2)21-22/h4-7H,8-9H2,1-3H3,(H,19,23)(H2,18,20,24)InChIKey
BQURKBCDYRKTNI-UHFFFAOYSA-NSynonyms
512817-86-61(3(4BROMO35DIMETHYLPYRAZOL1YL)PROPANOYLAMINO)3(4METHYLPHENYL)THIOUREA
2(3(4BROMO35DIMETHYL1HPYRAZOL1YL)PROPANOYL)N(4METHYLPHENYL)HYDRAZINECARBOTHIOAMIDE
512817866
CC1=CC=C(C=C1)NC(=S)NNC(=O)CCN2C(=C(C(=N2)C)Br)C
InChI=1SC16H20BrN5OSc1104613(7510)1816(24)201914(23)892212(3)15(17)11(2)2122h47H89H213H3(H1923)(H2182024)
MFCD03468175
ZINC000002731788
ZINC02731788
ZINC2731788
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