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

Systemtic Name: (3E)-3-(6-chloranyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-N,5-diphenyl-pyrazolidine-1-carbothioamide Openeye Name: (3E)-3-(6-chloro-2-oxo-4-phenyl-3-quinolylidene)-N,5-diphenyl-pyrazolidine-1-carbothioamide CAS Name: (3E)-3-(6-chloro-2-oxo-4-phenyl-3-quinolinylidene)-N,5-diphenyl-1-pyrazolidinecarbothioamide IUPAC Name: (3E)-3-(6-chloro-2-oxo-4-phenylquinolin-3-ylidene)-N,5-diphenylpyrazolidine-1-carbothioamide Traditional Name: (3E)-3-(6-chloro-2-keto-4-phenyl-3-quinolylidene)-N,5-diphenyl-pyrazolidine-1-carbothioamide Formula: C31H23ClN4OS MolecularWeight: 535.05852

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(NC1=C2C(=C3C=C(C=CC3=NC2=O)Cl)C4=CC=CC=C4)C(=S)NC5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C\1C(N(N/C1=C/2\C(=C3C=C(C=CC3=NC2=O)Cl)C4=CC=CC=C4)C(=S)NC5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H23ClN4OS/c32-22-16-17-25-24(18-22)28(21-12-6-2-7-13-21)29(30(37)34-25)26-19-27(20-10-4-1-5-11-20)36(35-26)31(38)33-23-14-8-3-9-15-23/h1-18,27,35H,19H2,(H,33,38)/b29-26+