N-butyl-3-(4-methylphenyl)cinnoline-4-carboxamide

Systemtic Name: N-butyl-3-(4-methylphenyl)cinnoline-4-carboxamide Openeye Name: N-butyl-3-(p-tolyl)cinnoline-4-carboxamide CAS Name: N-butyl-3-(4-methylphenyl)-4-cinnolinecarboxamide IUPAC Name: N-butyl-3-(4-methylphenyl)cinnoline-4-carboxamide Traditional Name: N-butyl-3-(p-tolyl)cinnoline-4-carboxamide Formula: C20H21N3O MolecularWeight: 319.40024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(N=NC2=CC=CC=C21)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCNC(=O)C1=C(N=NC2=CC=CC=C21)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H21N3O/c1-3-4-13-21-20(24)18-16-7-5-6-8-17(16)22-23-19(18)15-11-9-14(2)10-12-15/h5-12H,3-4,13H2,1-2H3,(H,21,24)