Vitas-M small molecule compound
ethyl 4-[({2-[(4-bromo-1,3-dimethyl-1H-pyrazol-5-yl)carbonyl]hydrazinyl}carbonothioyl)amino]benzoate
Catalog ID
STK456429
SMILES CCOC(=O)c1ccc(cc1)NC(=S)NNC(=O)c1n(C)nc(c1Br)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 C16H18BrN5O3S MW 440.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18BrN5O3S/c1-4-25-15(24)10-5-7-11(8-6-10)18-16(26)20-19-14(23)13-12(17)9(2)21-22(13)3/h5-8H,4H2,1-3H3,(H,19,23)(H2,18,20,26)InChIKey
OXAVMNOAQFAGSS-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=S)NNC(=O)C2=C(C(=NN2C)C)Br
ETHYL4(((((4BROMO13DIMETHYLPYRAZOL5YL)CARBONYLAMINO)AMINO)THIOXOMETHYL)AMINO)BENZOATE
ethyl4(((2((4bromo13dimethyl1Hpyrazol5yl)carbonyl)hydrazinyl)carbonothioyl)amino)benzoate
ETHYL4(((4BROMO25DIMETHYLPYRAZOLE3CARBONYL)AMINO)CARBAMOTHIOYLAMINO)BENZOATE
InChI=1SC16H18BrN5O3Sc142515(24)105711(8610)1816(26)201914(23)1312(17)9(2)2122(13)3h58H4H213H3(H1923)(H2182026)
MFCD05122906
ZINC000001118702
ZINC01118702
ZINC1118702
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