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

Systemtic Name: (3E)-3-(6-chloranyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-5-(3-nitrophenyl)-N-phenyl-pyrazolidine-1-carbothioamide Openeye Name: (3E)-3-(6-chloro-2-oxo-4-phenyl-3-quinolylidene)-5-(3-nitrophenyl)-N-phenyl-pyrazolidine-1-carbothioamide CAS Name: (3E)-3-(6-chloro-2-oxo-4-phenyl-3-quinolinylidene)-5-(3-nitrophenyl)-N-phenyl-1-pyrazolidinecarbothioamide IUPAC Name: (3E)-3-(6-chloro-2-oxo-4-phenylquinolin-3-ylidene)-5-(3-nitrophenyl)-N-phenylpyrazolidine-1-carbothioamide Traditional Name: (3E)-3-(6-chloro-2-keto-4-phenyl-3-quinolylidene)-5-(3-nitrophenyl)-N-phenyl-pyrazolidine-1-carbothioamide Formula: C31H22ClN5O3S MolecularWeight: 580.05608

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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)[N+](=O)[O-]

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)[N+](=O)[O-]

InChI

InChI=1S/C31H22ClN5O3S/c32-21-14-15-25-24(17-21)28(19-8-3-1-4-9-19)29(30(38)34-25)26-18-27(20-10-7-13-23(16-20)37(39)40)36(35-26)31(41)33-22-11-5-2-6-12-22/h1-17,27,35H,18H2,(H,33,41)/b29-26+