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

Systemtic Name: N-[2-(4-butylphenyl)-6-chloranyl-benzotriazol-5-yl]pyridine-3-carboxamide Openeye Name: N-[2-(4-butylphenyl)-6-chloro-benzotriazol-5-yl]pyridine-3-carboxamide CAS Name: N-[2-(4-butylphenyl)-6-chloro-5-benzotriazolyl]-3-pyridinecarboxamide IUPAC Name: N-[2-(4-butylphenyl)-6-chlorobenzotriazol-5-yl]pyridine-3-carboxamide Traditional Name: N-[2-(4-butylphenyl)-6-chloro-benzotriazol-5-yl]nicotinamide Formula: C22H20ClN5O MolecularWeight: 405.8801

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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=CN=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C22H20ClN5O/c1-2-3-5-15-7-9-17(10-8-15)28-26-20-12-18(23)19(13-21(20)27-28)25-22(29)16-6-4-11-24-14-16/h4,6-14H,2-3,5H2,1H3,(H,25,29)