N3-cyclooctyl-4-oxidanylidene-1-(oxolan-2-ylmethyl)-N5-(thiophen-3-ylmethyl)pyridine-3,5-dicarboxamide

Systemtic Name: N3-cyclooctyl-4-oxidanylidene-1-(oxolan-2-ylmethyl)-N5-(thiophen-3-ylmethyl)pyridine-3,5-dicarboxamide Openeye Name: N3-cyclooctyl-4-oxo-1-(tetrahydrofuran-2-ylmethyl)-N5-(3-thienylmethyl)pyridine-3,5-dicarboxamide CAS Name: N3-cyclooctyl-4-oxo-1-(2-oxolanylmethyl)-N5-(3-thiophenylmethyl)pyridine-3,5-dicarboxamide IUPAC Name: 3-N-cyclooctyl-4-oxo-1-(oxolan-2-ylmethyl)-5-N-(thiophen-3-ylmethyl)pyridine-3,5-dicarboxamide Traditional Name: N-cyclooctyl-4-keto-1-(tetrahydrofurfuryl)-N'-(3-thenyl)dinicotinamide Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)C2=CN(C=C(C2=O)C(=O)NCC3=CSC=C3)CC4CCCO4

Isomeric SMILES

C1CCCC(CCC1)NC(=O)C2=CN(C=C(C2=O)C(=O)NCC3=CSC=C3)CC4CCCO4

InChI

InChI=1S/C25H33N3O4S/c29-23-21(24(30)26-13-18-10-12-33-17-18)15-28(14-20-9-6-11-32-20)16-22(23)25(31)27-19-7-4-2-1-3-5-8-19/h10,12,15-17,19-20H,1-9,11,13-14H2,(H,26,30)(H,27,31)