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

Systemtic Name: (3E)-3-(6-chloranyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-5-(4-methoxyphenyl)-N-phenyl-pyrazolidine-1-carbothioamide Openeye Name: (3E)-3-(6-chloro-2-oxo-4-phenyl-3-quinolylidene)-5-(4-methoxyphenyl)-N-phenyl-pyrazolidine-1-carbothioamide CAS Name: (3E)-3-(6-chloro-2-oxo-4-phenyl-3-quinolinylidene)-5-(4-methoxyphenyl)-N-phenyl-1-pyrazolidinecarbothioamide IUPAC Name: (3E)-3-(6-chloro-2-oxo-4-phenylquinolin-3-ylidene)-5-(4-methoxyphenyl)-N-phenylpyrazolidine-1-carbothioamide Traditional Name: (3E)-3-(6-chloro-2-keto-4-phenyl-3-quinolylidene)-5-(4-methoxyphenyl)-N-phenyl-pyrazolidine-1-carbothioamide Formula: C32H25ClN4O2S MolecularWeight: 565.0845

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Descriptors Computed from Structure

Canonical SMILES:

COC1=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

COC1=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/C32H25ClN4O2S/c1-39-24-15-12-20(13-16-24)28-19-27(36-37(28)32(40)34-23-10-6-3-7-11-23)30-29(21-8-4-2-5-9-21)25-18-22(33)14-17-26(25)35-31(30)38/h2-18,28,36H,19H2,1H3,(H,34,40)/b30-27+