2-[6-(azepan-1-yl)-2-(4-chlorophenyl)pyrimidin-4-yl]-N-oxidanyl-ethanamide

Systemtic Name: 2-[6-(azepan-1-yl)-2-(4-chlorophenyl)pyrimidin-4-yl]-N-oxidanyl-ethanamide Openeye Name: 2-[6-(azepan-1-yl)-2-(4-chlorophenyl)pyrimidin-4-yl]ethanehydroxamic acid CAS Name: 2-[6-(1-azepanyl)-2-(4-chlorophenyl)-4-pyrimidinyl]-N-hydroxyacetamide IUPAC Name: 2-[6-(azepan-1-yl)-2-(4-chlorophenyl)pyrimidin-4-yl]-N-hydroxyacetamide Traditional Name: 2-[6-(azepan-1-yl)-2-(4-chlorophenyl)pyrimidin-4-yl]ethanehydroxamic acid Formula: C18H21ClN4O2 MolecularWeight: 360.83794

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=NC(=C2)CC(=O)NO)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCCN(CC1)C2=NC(=NC(=C2)CC(=O)NO)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H21ClN4O2/c19-14-7-5-13(6-8-14)18-20-15(12-17(24)22-25)11-16(21-18)23-9-3-1-2-4-10-23/h5-8,11,25H,1-4,9-10,12H2,(H,22,24)