N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-methyl-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-2-(2-thienyl)cinchoninamide Formula: C26H22N4OS MolecularWeight: 438.54408

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

Isomeric SMILES

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C26H22N4OS/c1-29(16-20-15-27-30(18-20)17-19-8-3-2-4-9-19)26(31)22-14-24(25-12-7-13-32-25)28-23-11-6-5-10-21(22)23/h2-15,18H,16-17H2,1H3