Vitas-M small molecule compound
N-[4-bromo-1-(4-chlorobenzyl)-1H-pyrazol-3-yl]-5-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
Catalog ID
STK445934
SMILES CCC1CCc2c(C1)cc(s2)C(=O)Nc1nn(cc1Br)Cc1ccc(cc1)Cl
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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 C21H21BrClN3OS MW 478.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrClN3OS/c1-2-13-5-8-18-15(9-13)10-19(28-18)21(27)24-20-17(22)12-26(25-20)11-14-3-6-16(23)7-4-14/h3-4,6-7,10,12-13H,2,5,8-9,11H2,1H3,(H,24,25,27)InChIKey
HPCLPGCPPDMGTQ-UHFFFAOYSA-NSynonyms
CCC1CCC2=C(C1)C=C(S2)C(=O)NC3=NN(C=C3Br)CC4=CC=C(C=C4)Cl
InChI=1SC21H21BrClN3OSc1213581815(913)1019(2818)21(27)242017(22)1226(2520)11143616(23)7414h3467101213H258911H21H3(H242527)
MFCD04058401
N(4bromo1((4chlorophenyl)methyl)pyrazol3yl)5ethyl4567tetrahydro1benzothiophene2carboxamide
N(4bromo1(4chlorobenzyl)1Hpyrazol3yl)5ethyl4567tetrahydro1benzothiophene2carboxamide
ZINC000020568559
ZINC000020568562
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