Vitas-M small molecule compound
3-bromo-N-(3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(4-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Catalog ID
STL404861
SMILES COc1ccc(cc1)c1cc(n2c(n1)c(Br)c(n2)C(=O)Nc1sc2c(c1C(=O)N)CCC(C2)C)C(F)(F)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 C25H21BrF3N5O3S MW 608.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21BrF3N5O3S/c1-11-3-8-14-16(9-11)38-24(18(14)21(30)35)32-23(36)20-19(26)22-31-15(12-4-6-13(37-2)7-5-12)10-17(25(27,28)29)34(22)33-20/h4-7,10-11H,3,8-9H2,1-2H3,(H2,30,35)(H,32,36)InChIKey
FMABFBGIXRQJCO-UHFFFAOYSA-NSynonyms
352692-77-4352692774
3bromoN(3carbamoyl6methyl4567tetrahydro1benzothiophen2yl)5(4methoxyphenyl)7(trifluoromethyl)pyrazolo(15a)pyrimidine2carboxamide
CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=NN4C(=CC(=NC4=C3Br)C5=CC=C(C=C5)OC)C(F)(F)F
InChI=1SC25H21BrF3N5O3Sc111381416(911)3824(18(14)21(30)35)3223(36)2019(26)223115(124613(372)7512)1017(25(2728)29)34(22)3320h471011H389H212H3(H23035)(H3236)
MFCD01919351
ZINC000008431701
ZINC000008431702
ZINC08431702
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