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

Systemtic Name: (3E)-3-(6-chloranyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-5-(4-dimethylaminophenyl)-N-phenyl-pyrazolidine-1-carbothioamide Openeye Name: (3E)-3-(6-chloro-2-oxo-4-phenyl-3-quinolylidene)-5-(4-dimethylaminophenyl)-N-phenyl-pyrazolidine-1-carbothioamide CAS Name: (3E)-3-(6-chloro-2-oxo-4-phenyl-3-quinolinylidene)-5-(4-dimethylaminophenyl)-N-phenyl-1-pyrazolidinecarbothioamide IUPAC Name: (3E)-3-(6-chloro-2-oxo-4-phenylquinolin-3-ylidene)-5-(4-dimethylaminophenyl)-N-phenylpyrazolidine-1-carbothioamide Traditional Name: (3E)-3-(6-chloro-2-keto-4-phenyl-3-quinolylidene)-5-(4-dimethylaminophenyl)-N-phenyl-pyrazolidine-1-carbothioamide Formula: C33H28ClN5OS MolecularWeight: 578.12632

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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)NC6=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)NC6=CC=CC=C6

InChI

InChI=1S/C33H28ClN5OS/c1-38(2)25-16-13-21(14-17-25)29-20-28(37-39(29)33(41)35-24-11-7-4-8-12-24)31-30(22-9-5-3-6-10-22)26-19-23(34)15-18-27(26)36-32(31)40/h3-19,29,37H,20H2,1-2H3,(H,35,41)/b31-28+