(5S)-3-(6-chloranyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-5-(4-chlorophenyl)-N-methyl-pyrazolidine-1-carbothioamide

Systemtic Name: (5S)-3-(6-chloranyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-5-(4-chlorophenyl)-N-methyl-pyrazolidine-1-carbothioamide Openeye Name: (5S)-3-(6-chloro-2-oxo-4-phenyl-3-quinolylidene)-5-(4-chlorophenyl)-N-methyl-pyrazolidine-1-carbothioamide CAS Name: (5S)-3-(6-chloro-2-oxo-4-phenyl-3-quinolinylidene)-5-(4-chlorophenyl)-N-methyl-1-pyrazolidinecarbothioamide IUPAC Name: (5S)-3-(6-chloro-2-oxo-4-phenylquinolin-3-ylidene)-5-(4-chlorophenyl)-N-methylpyrazolidine-1-carbothioamide Traditional Name: (5S)-3-(6-chloro-2-keto-4-phenyl-3-quinolylidene)-5-(4-chlorophenyl)-N-methyl-pyrazolidine-1-carbothioamide Formula: C26H20Cl2N4OS MolecularWeight: 507.4342

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1C(CC(=C2C(=C3C=C(C=CC3=NC2=O)Cl)C4=CC=CC=C4)N1)C5=CC=C(C=C5)Cl

Isomeric SMILES

CNC(=S)N1[C@@H](CC(=C2C(=C3C=C(C=CC3=NC2=O)Cl)C4=CC=CC=C4)N1)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C26H20Cl2N4OS/c1-29-26(34)32-22(15-7-9-17(27)10-8-15)14-21(31-32)24-23(16-5-3-2-4-6-16)19-13-18(28)11-12-20(19)30-25(24)33/h2-13,22,31H,14H2,1H3,(H,29,34)/t22-/m0/s1