N-[2-(3-fluorophenyl)ethyl]-4-oxidanylidene-1-(oxolan-2-ylmethyl)-5-(4-propan-2-ylpiperazin-1-yl)carbonyl-pyridine-3-carboxamide

Systemtic Name: N-[2-(3-fluorophenyl)ethyl]-4-oxidanylidene-1-(oxolan-2-ylmethyl)-5-(4-propan-2-ylpiperazin-1-yl)carbonyl-pyridine-3-carboxamide Openeye Name: N-[2-(3-fluorophenyl)ethyl]-5-(4-isopropylpiperazine-1-carbonyl)-4-oxo-1-(tetrahydrofuran-2-ylmethyl)pyridine-3-carboxamide CAS Name: N-[2-(3-fluorophenyl)ethyl]-4-oxo-1-(2-oxolanylmethyl)-5-[oxo-(4-propan-2-yl-1-piperazinyl)methyl]-3-pyridinecarboxamide IUPAC Name: N-[2-(3-fluorophenyl)ethyl]-4-oxo-1-(oxolan-2-ylmethyl)-5-(4-propan-2-ylpiperazine-1-carbonyl)pyridine-3-carboxamide Traditional Name: N-[2-(3-fluorophenyl)ethyl]-5-(4-isopropylpiperazine-1-carbonyl)-4-keto-1-(tetrahydrofurfuryl)nicotinamide Formula: C27H35FN4O4 MolecularWeight: 498.589603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C(=O)C2=CN(C=C(C2=O)C(=O)NCCC3=CC(=CC=C3)F)CC4CCCO4

Isomeric SMILES

CC(C)N1CCN(CC1)C(=O)C2=CN(C=C(C2=O)C(=O)NCCC3=CC(=CC=C3)F)CC4CCCO4

InChI

InChI=1S/C27H35FN4O4/c1-19(2)31-10-12-32(13-11-31)27(35)24-18-30(16-22-7-4-14-36-22)17-23(25(24)33)26(34)29-9-8-20-5-3-6-21(28)15-20/h3,5-6,15,17-19,22H,4,7-14,16H2,1-2H3,(H,29,34)