Vitas-M small molecule compound
N-(3-methylpent-1-yn-3-yl)-7-(trifluoromethyl)-5,6-dihydrobenzo[h]pyrazolo[5,1-b]quinazoline-10-carboxamide
Catalog ID
STK775245
SMILES CCC(NC(=O)c1nn2c(c1)nc1c(c2C(F)(F)F)CCc2c1cccc2)(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 C22H19F3N4O MW 412.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19F3N4O/c1-4-21(3,5-2)27-20(30)16-12-17-26-18-14-9-7-6-8-13(14)10-11-15(18)19(22(23,24)25)29(17)28-16/h1,6-9,12H,5,10-11H2,2-3H3,(H,27,30)InChIKey
VXOCTEILHCVIAM-UHFFFAOYSA-NSynonyms
CCC(C)(C#C)NC(=O)C1=NN2C(=C1)N=C3C(=C2C(F)(F)F)CCC4=CC=CC=C43
InChI=1SC22H19F3N4Oc1421(352)2720(30)161217261814976813(14)101115(18)19(22(2324)25)29(17)2816h16912H51011H223H3(H2730)
MFCD05256968
N((3S)3METHYLPENT1YN3YL)7(TRIFLUOROMETHYL)56DIHYDROBENZO(H)PYRAZOLO(51B)QUINAZOLINE10CARBOXAMIDE
N(3methylpent1yn3yl)7(trifluoromethyl)56dihydrobenzo(h)pyrazolo(51b)quinazoline10carboxamide
ZINC000001421914
ZINC000001421915
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