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

Systemtic Name: (3E)-3-(6-chloranyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-5-(4-dimethylaminophenyl)-N-(phenylmethyl)pyrazolidine-1-carbothioamide Openeye Name: (3E)-N-benzyl-3-(6-chloro-2-oxo-4-phenyl-3-quinolylidene)-5-(4-dimethylaminophenyl)pyrazolidine-1-carbothioamide CAS Name: (3E)-3-(6-chloro-2-oxo-4-phenyl-3-quinolinylidene)-5-(4-dimethylaminophenyl)-N-(phenylmethyl)-1-pyrazolidinecarbothioamide IUPAC Name: (3E)-N-benzyl-3-(6-chloro-2-oxo-4-phenylquinolin-3-ylidene)-5-(4-dimethylaminophenyl)pyrazolidine-1-carbothioamide Traditional Name: (3E)-N-benzyl-3-(6-chloro-2-keto-4-phenyl-3-quinolylidene)-5-(4-dimethylaminophenyl)pyrazolidine-1-carbothioamide Formula: C34H30ClN5OS MolecularWeight: 592.1529

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2CC(=C3C(=C4C=C(C=CC4=NC3=O)Cl)C5=CC=CC=C5)NN2C(=S)NCC6=CC=CC=C6

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2C/C(=C\3/C(=C4C=C(C=CC4=NC3=O)Cl)C5=CC=CC=C5)/NN2C(=S)NCC6=CC=CC=C6

InChI

InChI=1S/C34H30ClN5OS/c1-39(2)26-16-13-23(14-17-26)30-20-29(38-40(30)34(42)36-21-22-9-5-3-6-10-22)32-31(24-11-7-4-8-12-24)27-19-25(35)15-18-28(27)37-33(32)41/h3-19,30,38H,20-21H2,1-2H3,(H,36,42)/b32-29+