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

Systemtic Name: 4,4-dimethyl-6-oxidanylidene-2-(phenethylamino)-N-(4-phenoxyphenyl)cyclohexene-1-carbothioamide Openeye Name: 4,4-dimethyl-6-oxo-2-(phenethylamino)-N-(4-phenoxyphenyl)cyclohexene-1-carbothioamide CAS Name: 4,4-dimethyl-6-oxo-2-(phenethylamino)-N-(4-phenoxyphenyl)-1-cyclohexenecarbothioamide IUPAC Name: 4,4-dimethyl-6-oxo-2-(phenethylamino)-N-(4-phenoxyphenyl)cyclohexene-1-carbothioamide Traditional Name: 6-keto-4,4-dimethyl-2-(phenethylamino)-N-(4-phenoxyphenyl)cyclohexene-1-carbothioamide Formula: C29H30N2O2S MolecularWeight: 470.6257

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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)NCCC4=CC=CC=C4)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3)NCCC4=CC=CC=C4)C

InChI

InChI=1S/C29H30N2O2S/c1-29(2)19-25(30-18-17-21-9-5-3-6-10-21)27(26(32)20-29)28(34)31-22-13-15-24(16-14-22)33-23-11-7-4-8-12-23/h3-16,30H,17-20H2,1-2H3,(H,31,34)