N-[1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]pyridine-4-carboxamide

Systemtic Name: N-[1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]pyridine-4-carboxamide Openeye Name: N-[1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]pyridine-4-carboxamide CAS Name: N-[1-[2-(1-azocanyl)-4-methyl-5-pyrimidinyl]ethyl]-4-pyridinecarboxamide IUPAC Name: N-[1-[2-(azocan-1-yl)-4-methylpyrimidin-5-yl]ethyl]pyridine-4-carboxamide Traditional Name: N-[1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]isonicotinamide Formula: C20H27N5O MolecularWeight: 353.46128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(C)NC(=O)C2=CC=NC=C2)N3CCCCCCC3

Isomeric SMILES

CC1=NC(=NC=C1C(C)NC(=O)C2=CC=NC=C2)N3CCCCCCC3

InChI

InChI=1S/C20H27N5O/c1-15(23-19(26)17-8-10-21-11-9-17)18-14-22-20(24-16(18)2)25-12-6-4-3-5-7-13-25/h8-11,14-15H,3-7,12-13H2,1-2H3,(H,23,26)