Vitas-M small molecule compound
ethyl 2-[({2-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)acetyl]hydrazinyl}carbonothioyl)amino]-5-methyl-4-phenylthiophene-3-carboxylate
Catalog ID
STK455905
SMILES CCOC(=O)c1c(NC(=S)NNC(=O)Cn2nc(c(c2C)Br)C)sc(c1c1ccccc1)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 C22H24BrN5O3S2 MW 550.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24BrN5O3S2/c1-5-31-21(30)18-17(15-9-7-6-8-10-15)14(4)33-20(18)24-22(32)26-25-16(29)11-28-13(3)19(23)12(2)27-28/h6-10H,5,11H2,1-4H3,(H,25,29)(H2,24,26,32)InChIKey
UJZPDKVEAZJFDZ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=S)NNC(=O)CN3C(=C(C(=N3)C)Br)C
ETHYL2((((2(4BROMO35DIMETHYLPYRAZOLYL)ACETYLAMINO)AMINO)THIOXOMETHYL)AMINO)5METHYL4PHENYLTHIOPHENE3CARBOXYLATE
ethyl2(((2((4bromo35dimethyl1Hpyrazol1yl)acetyl)hydrazinyl)carbonothioyl)amino)5methyl4phenylthiophene3carboxylate
ETHYL2(((2((4BROMO35DIMETHYL1HPYRAZOL1YL)ACETYL)HYDRAZINYL)CARBOTHIOYL)AMINO)5METHYL4PHENYLTHIOPHENE3CARBOXYLATE
ETHYL2(((2(4BROMO35DIMETHYLPYRAZOL1YL)ACETYL)AMINO)CARBAMOTHIOYLAMINO)5METHYL4PHENYLTHIOPHENE3CARBOXYLATE
InChI=1SC22H24BrN5O3S2c153121(30)1817(1597681015)14(4)3320(18)2422(32)262516(29)112813(3)19(23)12(2)2728h610H511H214H3(H2529)(H2242632)
MFCD04227477
ZINC000002856922
ZINC2856922
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