N-[2-(4-butylphenyl)-6-chloranyl-benzotriazol-5-yl]-2-chloranyl-pyridine-3-carboxamide

Systemtic Name: N-[2-(4-butylphenyl)-6-chloranyl-benzotriazol-5-yl]-2-chloranyl-pyridine-3-carboxamide Openeye Name: N-[2-(4-butylphenyl)-6-chloro-benzotriazol-5-yl]-2-chloro-pyridine-3-carboxamide CAS Name: N-[2-(4-butylphenyl)-6-chloro-5-benzotriazolyl]-2-chloro-3-pyridinecarboxamide IUPAC Name: N-[2-(4-butylphenyl)-6-chlorobenzotriazol-5-yl]-2-chloropyridine-3-carboxamide Traditional Name: N-[2-(4-butylphenyl)-6-chloro-benzotriazol-5-yl]-2-chloro-nicotinamide Formula: C22H19Cl2N5O MolecularWeight: 440.32516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=O)C4=C(N=CC=C4)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=O)C4=C(N=CC=C4)Cl

InChI

InChI=1S/C22H19Cl2N5O/c1-2-3-5-14-7-9-15(10-8-14)29-27-19-12-17(23)18(13-20(19)28-29)26-22(30)16-6-4-11-25-21(16)24/h4,6-13H,2-3,5H2,1H3,(H,26,30)