Vitas-M small molecule compound
N-(7-tert-butyl-2-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-5-cyclopropyl-7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Catalog ID
STK303700
SMILES O=C(c1cnn2c1nc(cc2C(F)F)C1CC1)Nn1c(C)nc2c(c1=O)c1CCC(Cc1s2)C(C)(C)C
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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 C26H28F2N6O2S MW 526.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28F2N6O2S/c1-12-30-24-20(15-8-7-14(26(2,3)4)9-19(15)37-24)25(36)33(12)32-23(35)16-11-29-34-18(21(27)28)10-17(13-5-6-13)31-22(16)34/h10-11,13-14,21H,5-9H2,1-4H3,(H,32,35)InChIKey
BABPFUVAJZSZIE-UHFFFAOYSA-NSynonyms
676332-69-7676332697
CC1=NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C(=O)N1NC(=O)C4=C5N=C(C=C(N5N=C4)C(F)F)C6CC6
InChI=1SC26H28F2N6O2Sc112302420(158714(26(23)4)919(15)3724)25(36)33(12)3223(35)1611293418(21(27)28)1017(135613)3122(16)34h1011131421H59H214H3(H3235)
MFCD04044808
N(7tertbutyl2methyl4oxo5678tetrahydro(1)benzothieno(23d)pyrimidin3(4H)yl)5cyclopropyl7(difluoromethyl)pyrazolo(15a)pyrimidine3carboxamide
N(7tertbutyl2methyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin3yl)5cyclopropyl7(difluoromethyl)pyrazolo(15a)pyrimidine3carboxamide
ZINC000002778138
ZINC000002778139
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