4-[[5-butyl-1-(5-methyl-4-thiophen-2-yl-pyrimidin-2-yl)pyrazol-4-yl]methoxy]quinoline

Systemtic Name: 4-[[5-butyl-1-(5-methyl-4-thiophen-2-yl-pyrimidin-2-yl)pyrazol-4-yl]methoxy]quinoline Openeye Name: 4-[[5-butyl-1-[5-methyl-4-(2-thienyl)pyrimidin-2-yl]pyrazol-4-yl]methoxy]quinoline CAS Name: 4-[[5-butyl-1-(5-methyl-4-thiophen-2-yl-2-pyrimidinyl)-4-pyrazolyl]methoxy]quinoline IUPAC Name: 4-[[5-butyl-1-(5-methyl-4-thiophen-2-ylpyrimidin-2-yl)pyrazol-4-yl]methoxy]quinoline Traditional Name: 4-[[5-butyl-1-[5-methyl-4-(2-thienyl)pyrimidin-2-yl]pyrazol-4-yl]methoxy]quinoline Formula: C26H25N5OS MolecularWeight: 455.5746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=NN1C2=NC=C(C(=N2)C3=CC=CS3)C)COC4=CC=NC5=CC=CC=C54

Isomeric SMILES

CCCCC1=C(C=NN1C2=NC=C(C(=N2)C3=CC=CS3)C)COC4=CC=NC5=CC=CC=C54

InChI

InChI=1S/C26H25N5OS/c1-3-4-10-22-19(17-32-23-12-13-27-21-9-6-5-8-20(21)23)16-29-31(22)26-28-15-18(2)25(30-26)24-11-7-14-33-24/h5-9,11-16H,3-4,10,17H2,1-2H3