N-(2-chlorophenyl)-3-[(3-phenoxyphenyl)methylidene]-2-piperidin-1-yl-cyclopentene-1-carbothioamide

Systemtic Name: N-(2-chlorophenyl)-3-[(3-phenoxyphenyl)methylidene]-2-piperidin-1-yl-cyclopentene-1-carbothioamide Openeye Name: N-(2-chlorophenyl)-3-[(3-phenoxyphenyl)methylene]-2-(1-piperidyl)cyclopentene-1-carbothioamide CAS Name: N-(2-chlorophenyl)-3-[(3-phenoxyphenyl)methylidene]-2-(1-piperidinyl)-1-cyclopentenecarbothioamide IUPAC Name: N-(2-chlorophenyl)-3-[(3-phenoxyphenyl)methylidene]-2-piperidin-1-ylcyclopentene-1-carbothioamide Traditional Name: N-(2-chlorophenyl)-3-(3-phenoxybenzylidene)-2-piperidino-cyclopentene-1-carbothioamide Formula: C30H29ClN2OS MolecularWeight: 501.08206

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(CCC2=CC3=CC(=CC=C3)OC4=CC=CC=C4)C(=S)NC5=CC=CC=C5Cl

Isomeric SMILES

C1CCN(CC1)C2=C(CCC2=CC3=CC(=CC=C3)OC4=CC=CC=C4)C(=S)NC5=CC=CC=C5Cl

InChI

InChI=1S/C30H29ClN2OS/c31-27-14-5-6-15-28(27)32-30(35)26-17-16-23(29(26)33-18-7-2-8-19-33)20-22-10-9-13-25(21-22)34-24-11-3-1-4-12-24/h1,3-6,9-15,20-21H,2,7-8,16-19H2,(H,32,35)