N-[(1S)-1-(1-ethyl-3-methyl-pyrazol-4-yl)ethyl]-2-(3-methylphenyl)quinoline-4-carboxamide

Systemtic Name: N-[(1S)-1-(1-ethyl-3-methyl-pyrazol-4-yl)ethyl]-2-(3-methylphenyl)quinoline-4-carboxamide Openeye Name: N-[(1S)-1-(1-ethyl-3-methyl-pyrazol-4-yl)ethyl]-2-(m-tolyl)quinoline-4-carboxamide CAS Name: N-[(1S)-1-(1-ethyl-3-methyl-4-pyrazolyl)ethyl]-2-(3-methylphenyl)-4-quinolinecarboxamide IUPAC Name: N-[(1S)-1-(1-ethyl-3-methylpyrazol-4-yl)ethyl]-2-(3-methylphenyl)quinoline-4-carboxamide Traditional Name: N-[(1S)-1-(1-ethyl-3-methyl-pyrazol-4-yl)ethyl]-2-(m-tolyl)cinchoninamide Formula: C25H26N4O MolecularWeight: 398.50014

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C(C)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=CC=C4)C

Isomeric SMILES

CCN1C=C(C(=N1)C)[C@H](C)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=CC=C4)C

InChI

InChI=1S/C25H26N4O/c1-5-29-15-22(18(4)28-29)17(3)26-25(30)21-14-24(19-10-8-9-16(2)13-19)27-23-12-7-6-11-20(21)23/h6-15,17H,5H2,1-4H3,(H,26,30)/t17-/m0/s1