3-[(2,4-dichlorophenyl)methylidene]-N-(3,4-dimethylphenyl)-2-morpholin-4-yl-cyclopentene-1-carbothioamide

Systemtic Name: 3-[(2,4-dichlorophenyl)methylidene]-N-(3,4-dimethylphenyl)-2-morpholin-4-yl-cyclopentene-1-carbothioamide Openeye Name: 3-[(2,4-dichlorophenyl)methylene]-N-(3,4-dimethylphenyl)-2-morpholino-cyclopentene-1-carbothioamide CAS Name: 3-[(2,4-dichlorophenyl)methylidene]-N-(3,4-dimethylphenyl)-2-(4-morpholinyl)-1-cyclopentenecarbothioamide IUPAC Name: 3-[(2,4-dichlorophenyl)methylidene]-N-(3,4-dimethylphenyl)-2-morpholin-4-ylcyclopentene-1-carbothioamide Traditional Name: 3-(2,4-dichlorobenzylidene)-N-(3,4-dimethylphenyl)-2-morpholino-cyclopentene-1-carbothioamide Formula: C25H26Cl2N2OS MolecularWeight: 473.45774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)C2=C(C(=CC3=C(C=C(C=C3)Cl)Cl)CC2)N4CCOCC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)C2=C(C(=CC3=C(C=C(C=C3)Cl)Cl)CC2)N4CCOCC4)C

InChI

InChI=1S/C25H26Cl2N2OS/c1-16-3-7-21(13-17(16)2)28-25(31)22-8-5-19(24(22)29-9-11-30-12-10-29)14-18-4-6-20(26)15-23(18)27/h3-4,6-7,13-15H,5,8-12H2,1-2H3,(H,28,31)