Vitas-M small molecule compound
ethyl 2-({[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK961062
SMILES CCOC(=O)c1c(sc2c1CCCC2)NC(=O)c1cnn2c1nc(cc2C(F)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 C25H22F2N4O3S MW 496.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22F2N4O3S/c1-2-34-25(33)20-15-10-6-7-11-19(15)35-24(20)30-23(32)16-13-28-31-18(21(26)27)12-17(29-22(16)31)14-8-4-3-5-9-14/h3-5,8-9,12-13,21H,2,6-7,10-11H2,1H3,(H,30,32)InChIKey
VCABRFMZAGPCQB-UHFFFAOYSA-NSynonyms
445038-31-3445038313
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=C4N=C(C=C(N4N=C3)C(F)F)C5=CC=CC=C5
ethyl2(((7(difluoromethyl)5phenylpyrazolo(15a)pyrimidin3yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((7(difluoromethyl)5phenylpyrazolo(15a)pyrimidine3carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC25H22F2N4O3Sc123425(33)201510671119(15)3524(20)3023(32)1613283118(21(26)27)1217(2922(16)31)148435914h3589121321H2671011H21H3(H3032)
MFCD02243817
ZINC000002107778
ZINC02107778
ZINC2107778
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