6-chloranyl-N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-(5-ethylthiophen-2-yl)quinoline-4-carboxamide

Systemtic Name: 6-chloranyl-N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-(5-ethylthiophen-2-yl)quinoline-4-carboxamide Openeye Name: 6-chloro-N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-(5-ethyl-2-thienyl)quinoline-4-carboxamide CAS Name: 6-chloro-N-[(1,3-diphenyl-4-pyrazolyl)methyl]-2-(5-ethyl-2-thiophenyl)-4-quinolinecarboxamide IUPAC Name: 6-chloro-N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-(5-ethylthiophen-2-yl)quinoline-4-carboxamide Traditional Name: 6-chloro-N-[(1,3-diphenylpyrazol-4-yl)methyl]-2-(5-ethyl-2-thienyl)cinchoninamide Formula: C32H25ClN4OS MolecularWeight: 549.0851

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)NCC4=CN(N=C4C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CCC1=CC=C(S1)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)NCC4=CN(N=C4C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C32H25ClN4OS/c1-2-25-14-16-30(39-25)29-18-27(26-17-23(33)13-15-28(26)35-29)32(38)34-19-22-20-37(24-11-7-4-8-12-24)36-31(22)21-9-5-3-6-10-21/h3-18,20H,2,19H2,1H3,(H,34,38)