(3E)-3-(6-chloranyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-5-(4-dimethylaminophenyl)-N-methyl-pyrazolidine-1-carbothioamide

Systemtic Name: (3E)-3-(6-chloranyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-5-(4-dimethylaminophenyl)-N-methyl-pyrazolidine-1-carbothioamide Openeye Name: (3E)-3-(6-chloro-2-oxo-4-phenyl-3-quinolylidene)-5-(4-dimethylaminophenyl)-N-methyl-pyrazolidine-1-carbothioamide CAS Name: (3E)-3-(6-chloro-2-oxo-4-phenyl-3-quinolinylidene)-5-(4-dimethylaminophenyl)-N-methyl-1-pyrazolidinecarbothioamide IUPAC Name: (3E)-3-(6-chloro-2-oxo-4-phenylquinolin-3-ylidene)-5-(4-dimethylaminophenyl)-N-methylpyrazolidine-1-carbothioamide Traditional Name: (3E)-3-(6-chloro-2-keto-4-phenyl-3-quinolylidene)-5-(4-dimethylaminophenyl)-N-methyl-pyrazolidine-1-carbothioamide Formula: C28H26ClN5OS MolecularWeight: 516.05694

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1C(CC(=C2C(=C3C=C(C=CC3=NC2=O)Cl)C4=CC=CC=C4)N1)C5=CC=C(C=C5)N(C)C

Isomeric SMILES

CNC(=S)N1C(C/C(=C\2/C(=C3C=C(C=CC3=NC2=O)Cl)C4=CC=CC=C4)/N1)C5=CC=C(C=C5)N(C)C

InChI

InChI=1S/C28H26ClN5OS/c1-30-28(36)34-24(17-9-12-20(13-10-17)33(2)3)16-23(32-34)26-25(18-7-5-4-6-8-18)21-15-19(29)11-14-22(21)31-27(26)35/h4-15,24,32H,16H2,1-3H3,(H,30,36)/b26-23+