Vitas-M small molecule compound
1-methyl-N-(2-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
Catalog ID
STK304263
SMILES O=C(c1nn(c(c1)C(F)(F)F)C)Nn1c(C)nc2c(c1=O)c1CCCCc1s2
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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 C17H16F3N5O2S MW 411.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16F3N5O2S/c1-8-21-15-13(9-5-3-4-6-11(9)28-15)16(27)25(8)23-14(26)10-7-12(17(18,19)20)24(2)22-10/h7H,3-6H2,1-2H3,(H,23,26)InChIKey
REOOOYSGCFQTFK-UHFFFAOYSA-NSynonyms
1005659-20-01005659200
1methylN(2methyl4oxo5678tetrahydro(1)benzothieno(23d)pyrimidin3(4H)yl)5(trifluoromethyl)1Hpyrazole3carboxamide
1methylN(2methyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin3yl)5(trifluoromethyl)pyrazole3carboxamide
CC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1NC(=O)C4=NN(C(=C4)C(F)(F)F)C
InChI=1SC17H16F3N5O2Sc18211513(9534611(9)2815)16(27)25(8)2314(26)10712(17(1819)20)24(2)2210h7H36H212H3(H2326)
MFCD04043896
ZINC000002780476
ZINC02780476
ZINC2780476
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