6-methyl-N-(3-methylbutyl)-2-[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]quinoline-4-carboxamide

Systemtic Name: 6-methyl-N-(3-methylbutyl)-2-[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]quinoline-4-carboxamide Openeye Name: N-isopentyl-6-methyl-2-[5-methyl-1-(p-tolyl)pyrazol-4-yl]quinoline-4-carboxamide CAS Name: 6-methyl-N-(3-methylbutyl)-2-[5-methyl-1-(4-methylphenyl)-4-pyrazolyl]-4-quinolinecarboxamide IUPAC Name: 6-methyl-N-(3-methylbutyl)-2-[5-methyl-1-(4-methylphenyl)pyrazol-4-yl]quinoline-4-carboxamide Traditional Name: N-isoamyl-6-methyl-2-[5-methyl-1-(p-tolyl)pyrazol-4-yl]cinchoninamide Formula: C27H30N4O MolecularWeight: 426.5533

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=N2)C3=NC4=C(C=C(C=C4)C)C(=C3)C(=O)NCCC(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=N2)C3=NC4=C(C=C(C=C4)C)C(=C3)C(=O)NCCC(C)C)C

InChI

InChI=1S/C27H30N4O/c1-17(2)12-13-28-27(32)23-15-26(30-25-11-8-19(4)14-22(23)25)24-16-29-31(20(24)5)21-9-6-18(3)7-10-21/h6-11,14-17H,12-13H2,1-5H3,(H,28,32)