Vitas-M small molecule compound
5-ethyl-N-[1-(4-fluorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
Catalog ID
STK445776
SMILES CCC1CCc2c(C1)cc(s2)C(=O)Nc1c(C)nn(c1C)Cc1ccc(cc1)F
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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 C23H26FN3OS MW 411.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26FN3OS/c1-4-16-7-10-20-18(11-16)12-21(29-20)23(28)25-22-14(2)26-27(15(22)3)13-17-5-8-19(24)9-6-17/h5-6,8-9,12,16H,4,7,10-11,13H2,1-3H3,(H,25,28)InChIKey
XHGUTNVJHMNPLR-UHFFFAOYSA-NSynonyms
5ethylN(1((4fluorophenyl)methyl)35dimethylpyrazol4yl)4567tetrahydro1benzothiophene2carboxamide
5ethylN(1(4fluorobenzyl)35dimethyl1Hpyrazol4yl)4567tetrahydro1benzothiophene2carboxamide
CCC1CCC2=C(C1)C=C(S2)C(=O)NC3=C(N(N=C3C)CC4=CC=C(C=C4)F)C
InChI=1SC23H26FN3OSc14167102018(1116)1221(2920)23(28)252214(2)2627(15(22)3)13175819(24)9617h56891216H47101113H213H3(H2528)
MFCD04058282
ZINC000006489369
ZINC000006489688
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