Vitas-M small molecule compound
1-(4-bromo-2-chlorophenyl)-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)thiourea
Catalog ID
STK457484
SMILES S=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)Nc1ccc(cc1Cl)Br
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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 C18H16BrClN4OS MW 451.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16BrClN4OS/c1-11-16(17(25)24(23(11)2)13-6-4-3-5-7-13)22-18(26)21-15-9-8-12(19)10-14(15)20/h3-10H,1-2H3,(H2,21,22,26)InChIKey
KBKYXMNOPXJCPJ-UHFFFAOYSA-NSynonyms
1(4bromo2chlorophenyl)3(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)thiourea
1(4BROMO2CHLOROPHENYL)3(15DIMETHYL3OXO2PHENYLPYRAZOL4YL)THIOUREA
4((((4BROMO2CHLOROPHENYL)AMINO)THIOXOMETHYL)AMINO)23DIMETHYL1PHENYL3PYRAZOLIN5ONE
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=S)NC3=C(C=C(C=C3)Br)Cl
InChI=1SC18H16BrClN4OSc11116(17(25)24(23(11)2)136435713)2218(26)21159812(19)1014(15)20h310H12H3(H2212226)
MFCD05059649
ZINC000001122039
ZINC01122039
ZINC1122039
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