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

Systemtic Name: 4-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl]-N-(pyridin-3-ylmethyl)cyclohexane-1-carboxamide Openeye Name: 4-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]-N-(3-pyridylmethyl)cyclohexanecarboxamide CAS Name: 4-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]-N-(3-pyridinylmethyl)-1-cyclohexanecarboxamide IUPAC Name: 4-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]-N-(pyridin-3-ylmethyl)cyclohexane-1-carboxamide Traditional Name: 4-[(4-keto-1,2,3-benzotriazin-3-yl)methyl]-N-(3-pyridylmethyl)cyclohexanecarboxamide Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN2C(=O)C3=CC=CC=C3N=N2)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1CC(CCC1CN2C(=O)C3=CC=CC=C3N=N2)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C21H23N5O2/c27-20(23-13-16-4-3-11-22-12-16)17-9-7-15(8-10-17)14-26-21(28)18-5-1-2-6-19(18)24-25-26/h1-6,11-12,15,17H,7-10,13-14H2,(H,23,27)