N-(5-chloranylpyridin-2-yl)-4-[(4-oxidanylidenequinazolin-3-yl)methyl]cyclohexane-1-carboxamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-4-[(4-oxidanylidenequinazolin-3-yl)methyl]cyclohexane-1-carboxamide Openeye Name: N-(5-chloro-2-pyridyl)-4-[(4-oxoquinazolin-3-yl)methyl]cyclohexanecarboxamide CAS Name: N-(5-chloro-2-pyridinyl)-4-[(4-oxo-3-quinazolinyl)methyl]-1-cyclohexanecarboxamide IUPAC Name: N-(5-chloropyridin-2-yl)-4-[(4-oxoquinazolin-3-yl)methyl]cyclohexane-1-carboxamide Traditional Name: N-(5-chloro-2-pyridyl)-4-[(4-ketoquinazolin-3-yl)methyl]cyclohexanecarboxamide Formula: C21H21ClN4O2 MolecularWeight: 396.87004

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN2C=NC3=CC=CC=C3C2=O)C(=O)NC4=NC=C(C=C4)Cl

Isomeric SMILES

C1CC(CCC1CN2C=NC3=CC=CC=C3C2=O)C(=O)NC4=NC=C(C=C4)Cl

InChI

InChI=1S/C21H21ClN4O2/c22-16-9-10-19(23-11-16)25-20(27)15-7-5-14(6-8-15)12-26-13-24-18-4-2-1-3-17(18)21(26)28/h1-4,9-11,13-15H,5-8,12H2,(H,23,25,27)