N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N,6-dimethyl-4-oxidanylidene-1H-quinoline-2-carboxamide

Systemtic Name: N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N,6-dimethyl-4-oxidanylidene-1H-quinoline-2-carboxamide Openeye Name: N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N,6-dimethyl-4-oxo-1H-quinoline-2-carboxamide CAS Name: N-[[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]methyl]-N,6-dimethyl-4-oxo-1H-quinoline-2-carboxamide IUPAC Name: N-[[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methyl]-N,6-dimethyl-4-oxo-1H-quinoline-2-carboxamide Traditional Name: N-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-4-keto-N,6-dimethyl-1H-quinoline-2-carboxamide Formula: C28H23ClN4O2 MolecularWeight: 482.96082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=CC2=O)C(=O)N(C)CC3=CN(N=C3C4=CC=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=CC2=O)C(=O)N(C)CC3=CN(N=C3C4=CC=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C28H23ClN4O2/c1-18-8-13-24-23(14-18)26(34)15-25(30-24)28(35)32(2)16-20-17-33(22-6-4-3-5-7-22)31-27(20)19-9-11-21(29)12-10-19/h3-15,17H,16H2,1-2H3,(H,30,34)