Vitas-M small molecule compound
ethyl 4-[({2-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)acetyl]hydrazinyl}carbonothioyl)amino]benzoate
Catalog ID
STL402840
SMILES CCOC(=O)c1ccc(cc1)NC(=S)NNC(=O)Cn1nc(c(c1C)Br)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 C17H20BrN5O3S MW 454.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20BrN5O3S/c1-4-26-16(25)12-5-7-13(8-6-12)19-17(27)21-20-14(24)9-23-11(3)15(18)10(2)22-23/h5-8H,4,9H2,1-3H3,(H,20,24)(H2,19,21,27)InChIKey
UAXYXZVKSOVIBO-UHFFFAOYSA-NSynonyms
894381-16-9894381169
CCOC(=O)C1=CC=C(C=C1)NC(=S)NNC(=O)CN2C(=C(C(=N2)C)Br)C
ethyl4(((2((4bromo35dimethyl1Hpyrazol1yl)acetyl)hydrazinyl)carbonothioyl)amino)benzoate
ethyl4(((2(4bromo35dimethylpyrazol1yl)acetyl)amino)carbamothioylamino)benzoate
InChI=1SC17H20BrN5O3Sc142616(25)125713(8612)1917(27)212014(24)92311(3)15(18)10(2)2223h58H49H213H3(H2024)(H2192127)
MFCD04136117
ZINC000002805343
ZINC02805343
ZINC2805343
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