4,4-dimethyl-2-(2-morpholin-4-ylethylamino)-6-oxidanylidene-N-(4-phenoxyphenyl)cyclohexene-1-carbothioamide

Systemtic Name: 4,4-dimethyl-2-(2-morpholin-4-ylethylamino)-6-oxidanylidene-N-(4-phenoxyphenyl)cyclohexene-1-carbothioamide Openeye Name: 4,4-dimethyl-2-(2-morpholinoethylamino)-6-oxo-N-(4-phenoxyphenyl)cyclohexene-1-carbothioamide CAS Name: 4,4-dimethyl-2-[2-(4-morpholinyl)ethylamino]-6-oxo-N-(4-phenoxyphenyl)-1-cyclohexenecarbothioamide IUPAC Name: 4,4-dimethyl-2-(2-morpholin-4-ylethylamino)-6-oxo-N-(4-phenoxyphenyl)cyclohexene-1-carbothioamide Traditional Name: 6-keto-4,4-dimethyl-2-(2-morpholinoethylamino)-N-(4-phenoxyphenyl)cyclohexene-1-carbothioamide Formula: C27H33N3O3S MolecularWeight: 479.63422

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3)NCCN4CCOCC4)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3)NCCN4CCOCC4)C

InChI

InChI=1S/C27H33N3O3S/c1-27(2)18-23(28-12-13-30-14-16-32-17-15-30)25(24(31)19-27)26(34)29-20-8-10-22(11-9-20)33-21-6-4-3-5-7-21/h3-11,28H,12-19H2,1-2H3,(H,29,34)