4-tert-butyl-N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]benzamide Openeye Name: 4-tert-butyl-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]benzamide CAS Name: 4-tert-butyl-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]benzamide Traditional Name: 4-tert-butyl-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]benzamide Formula: C19H19ClN4O MolecularWeight: 354.83336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)Cl)N3C=NC=N3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)Cl)N3C=NC=N3

InChI

InChI=1S/C19H19ClN4O/c1-19(2,3)14-6-4-13(5-7-14)18(25)23-16-10-15(20)8-9-17(16)24-12-21-11-22-24/h4-12H,1-3H3,(H,23,25)