2-(3-butoxyphenyl)-N-[4-[(3,5-dimethylpyrazol-1-yl)methyl]phenyl]quinoline-4-carboxamide

Systemtic Name: 2-(3-butoxyphenyl)-N-[4-[(3,5-dimethylpyrazol-1-yl)methyl]phenyl]quinoline-4-carboxamide Openeye Name: 2-(3-butoxyphenyl)-N-[4-[(3,5-dimethylpyrazol-1-yl)methyl]phenyl]quinoline-4-carboxamide CAS Name: 2-(3-butoxyphenyl)-N-[4-[(3,5-dimethyl-1-pyrazolyl)methyl]phenyl]-4-quinolinecarboxamide IUPAC Name: 2-(3-butoxyphenyl)-N-[4-[(3,5-dimethylpyrazol-1-yl)methyl]phenyl]quinoline-4-carboxamide Traditional Name: 2-(3-butoxyphenyl)-N-[4-[(3,5-dimethylpyrazol-1-yl)methyl]phenyl]cinchoninamide Formula: C32H32N4O2 MolecularWeight: 504.62208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=C(C=C4)CN5C(=CC(=N5)C)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=C(C=C4)CN5C(=CC(=N5)C)C

InChI

InChI=1S/C32H32N4O2/c1-4-5-17-38-27-10-8-9-25(19-27)31-20-29(28-11-6-7-12-30(28)34-31)32(37)33-26-15-13-24(14-16-26)21-36-23(3)18-22(2)35-36/h6-16,18-20H,4-5,17,21H2,1-3H3,(H,33,37)