2-morpholin-4-yl-N-phenyl-3-[(3,4,5-trimethoxyphenyl)methylidene]cyclopentene-1-carbothioamide

Systemtic Name: 2-morpholin-4-yl-N-phenyl-3-[(3,4,5-trimethoxyphenyl)methylidene]cyclopentene-1-carbothioamide Openeye Name: 2-morpholino-N-phenyl-3-[(3,4,5-trimethoxyphenyl)methylene]cyclopentene-1-carbothioamide CAS Name: 2-(4-morpholinyl)-N-phenyl-3-[(3,4,5-trimethoxyphenyl)methylidene]-1-cyclopentenecarbothioamide IUPAC Name: 2-morpholin-4-yl-N-phenyl-3-[(3,4,5-trimethoxyphenyl)methylidene]cyclopentene-1-carbothioamide Traditional Name: 2-morpholino-N-phenyl-3-(3,4,5-trimethoxybenzylidene)cyclopentene-1-carbothioamide Formula: C26H30N2O4S MolecularWeight: 466.5924

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=C2CCC(=C2N3CCOCC3)C(=S)NC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C=C2CCC(=C2N3CCOCC3)C(=S)NC4=CC=CC=C4

InChI

InChI=1S/C26H30N2O4S/c1-29-22-16-18(17-23(30-2)25(22)31-3)15-19-9-10-21(24(19)28-11-13-32-14-12-28)26(33)27-20-7-5-4-6-8-20/h4-8,15-17H,9-14H2,1-3H3,(H,27,33)