Vitas-M small molecule compound
methyl 2-({[1-(4-fluorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]carbamothioyl}amino)-5-phenylthiophene-3-carboxylate
Catalog ID
STK438708
SMILES COC(=O)c1cc(sc1NC(=S)Nc1c(C)nn(c1C)Cc1ccc(cc1)F)c1ccccc1
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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 C25H23FN4O2S2 MW 494.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23FN4O2S2/c1-15-22(16(2)30(29-15)14-17-9-11-19(26)12-10-17)27-25(33)28-23-20(24(31)32-3)13-21(34-23)18-7-5-4-6-8-18/h4-13H,14H2,1-3H3,(H2,27,28,33)InChIKey
YGNJZFCHDGAACE-UHFFFAOYSA-NSynonyms
CC1=C(C(=NN1CC2=CC=C(C=C2)F)C)NC(=S)NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)OC
InChI=1SC25H23FN4O2S2c11522(16(2)30(2915)141791119(26)121017)2725(33)282320(24(31)323)1321(3423)187546818h413H14H213H3(H2272833)
METHYL2((((1((4FLUOROPHENYL)METHYL)35DIMETHYLPYRAZOL4YL)AMINO)THIOXOMETHYL)AMINO)5PHENYLTHIOPHENE3CARBOXYLATE
methyl2(((1(4fluorobenzyl)35dimethyl1Hpyrazol4yl)carbamothioyl)amino)5phenylthiophene3carboxylate
METHYL2((1((4FLUOROPHENYL)METHYL)35DIMETHYLPYRAZOL4YL)CARBAMOTHIOYLAMINO)5PHENYLTHIOPHENE3CARBOXYLATE
MFCD03945688
ZINC000020294388
ZINC20294388
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