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

Systemtic Name: N-(5-chloranylpyridin-2-yl)-4-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl]cyclohexane-1-carboxamide Openeye Name: N-(5-chloro-2-pyridyl)-4-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]cyclohexanecarboxamide CAS Name: N-(5-chloro-2-pyridinyl)-4-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]-1-cyclohexanecarboxamide IUPAC Name: N-(5-chloropyridin-2-yl)-4-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]cyclohexane-1-carboxamide Traditional Name: N-(5-chloro-2-pyridyl)-4-[(4-keto-1,2,3-benzotriazin-3-yl)methyl]cyclohexanecarboxamide Formula: C20H20ClN5O2 MolecularWeight: 397.8581

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN2C(=O)C3=CC=CC=C3N=N2)C(=O)NC4=NC=C(C=C4)Cl

Isomeric SMILES

C1CC(CCC1CN2C(=O)C3=CC=CC=C3N=N2)C(=O)NC4=NC=C(C=C4)Cl

InChI

InChI=1S/C20H20ClN5O2/c21-15-9-10-18(22-11-15)23-19(27)14-7-5-13(6-8-14)12-26-20(28)16-3-1-2-4-17(16)24-25-26/h1-4,9-11,13-14H,5-8,12H2,(H,22,23,27)