N-(4-tert-butylphenyl)-2-[(2-chloranylpyridin-4-yl)methylamino]pyridine-3-carboxamide

Systemtic Name: N-(4-tert-butylphenyl)-2-[(2-chloranylpyridin-4-yl)methylamino]pyridine-3-carboxamide Openeye Name: N-(4-tert-butylphenyl)-2-[(2-chloro-4-pyridyl)methylamino]pyridine-3-carboxamide CAS Name: N-(4-tert-butylphenyl)-2-[(2-chloro-4-pyridinyl)methylamino]-3-pyridinecarboxamide IUPAC Name: N-(4-tert-butylphenyl)-2-[(2-chloropyridin-4-yl)methylamino]pyridine-3-carboxamide Traditional Name: N-(4-tert-butylphenyl)-2-[(2-chloro-4-pyridyl)methylamino]nicotinamide Formula: C22H23ClN4O MolecularWeight: 394.89722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2=C(N=CC=C2)NCC3=CC(=NC=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2=C(N=CC=C2)NCC3=CC(=NC=C3)Cl

InChI

InChI=1S/C22H23ClN4O/c1-22(2,3)16-6-8-17(9-7-16)27-21(28)18-5-4-11-25-20(18)26-14-15-10-12-24-19(23)13-15/h4-13H,14H2,1-3H3,(H,25,26)(H,27,28)