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

Systemtic Name: 2-[1-(4-methoxyphenyl)-5-methyl-pyrazol-4-yl]-6-methyl-N-(3-methylbutyl)quinoline-4-carboxamide Openeye Name: N-isopentyl-2-[1-(4-methoxyphenyl)-5-methyl-pyrazol-4-yl]-6-methyl-quinoline-4-carboxamide CAS Name: 2-[1-(4-methoxyphenyl)-5-methyl-4-pyrazolyl]-6-methyl-N-(3-methylbutyl)-4-quinolinecarboxamide IUPAC Name: 2-[1-(4-methoxyphenyl)-5-methylpyrazol-4-yl]-6-methyl-N-(3-methylbutyl)quinoline-4-carboxamide Traditional Name: N-isoamyl-2-[1-(4-methoxyphenyl)-5-methyl-pyrazol-4-yl]-6-methyl-cinchoninamide Formula: C27H30N4O2 MolecularWeight: 442.5527

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NCCC(C)C)C3=C(N(N=C3)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NCCC(C)C)C3=C(N(N=C3)C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C27H30N4O2/c1-17(2)12-13-28-27(32)23-15-26(30-25-11-6-18(3)14-22(23)25)24-16-29-31(19(24)4)20-7-9-21(33-5)10-8-20/h6-11,14-17H,12-13H2,1-5H3,(H,28,32)