N-(3-fluoranyl-4-methyl-phenyl)-2-(3-morpholin-4-ylcarbonyl-5-thiophen-2-yl-pyrazol-1-yl)ethanamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-2-(3-morpholin-4-ylcarbonyl-5-thiophen-2-yl-pyrazol-1-yl)ethanamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-2-[3-(morpholine-4-carbonyl)-5-(2-thienyl)pyrazol-1-yl]acetamide CAS Name: N-(3-fluoro-4-methylphenyl)-2-[3-[4-morpholinyl(oxo)methyl]-5-thiophen-2-yl-1-pyrazolyl]acetamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-2-[3-(morpholine-4-carbonyl)-5-thiophen-2-ylpyrazol-1-yl]acetamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-2-[3-(morpholine-4-carbonyl)-5-(2-thienyl)pyrazol-1-yl]acetamide Formula: C21H21FN4O3S MolecularWeight: 428.479843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN2C(=CC(=N2)C(=O)N3CCOCC3)C4=CC=CS4)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN2C(=CC(=N2)C(=O)N3CCOCC3)C4=CC=CS4)F

InChI

InChI=1S/C21H21FN4O3S/c1-14-4-5-15(11-16(14)22)23-20(27)13-26-18(19-3-2-10-30-19)12-17(24-26)21(28)25-6-8-29-9-7-25/h2-5,10-12H,6-9,13H2,1H3,(H,23,27)