3-[[4-(diethylamino)phenyl]methylidene]-2-morpholin-4-yl-N-phenyl-cyclopentene-1-carbothioamide

Systemtic Name: 3-[[4-(diethylamino)phenyl]methylidene]-2-morpholin-4-yl-N-phenyl-cyclopentene-1-carbothioamide Openeye Name: 3-[[4-(diethylamino)phenyl]methylene]-2-morpholino-N-phenyl-cyclopentene-1-carbothioamide CAS Name: 3-[[4-(diethylamino)phenyl]methylidene]-2-(4-morpholinyl)-N-phenyl-1-cyclopentenecarbothioamide IUPAC Name: 3-[[4-(diethylamino)phenyl]methylidene]-2-morpholin-4-yl-N-phenylcyclopentene-1-carbothioamide Traditional Name: 3-[4-(diethylamino)benzylidene]-2-morpholino-N-phenyl-cyclopentene-1-carbothioamide Formula: C27H33N3OS MolecularWeight: 447.63542

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C=C2CCC(=C2N3CCOCC3)C(=S)NC4=CC=CC=C4

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C=C2CCC(=C2N3CCOCC3)C(=S)NC4=CC=CC=C4

InChI

InChI=1S/C27H33N3OS/c1-3-29(4-2)24-13-10-21(11-14-24)20-22-12-15-25(26(22)30-16-18-31-19-17-30)27(32)28-23-8-6-5-7-9-23/h5-11,13-14,20H,3-4,12,15-19H2,1-2H3,(H,28,32)