2-[(4-methoxyphenyl)methylamino]-4,4-dimethyl-6-oxidanylidene-N-(4-phenoxyphenyl)cyclohexene-1-carbothioamide

Systemtic Name: 2-[(4-methoxyphenyl)methylamino]-4,4-dimethyl-6-oxidanylidene-N-(4-phenoxyphenyl)cyclohexene-1-carbothioamide Openeye Name: 2-[(4-methoxyphenyl)methylamino]-4,4-dimethyl-6-oxo-N-(4-phenoxyphenyl)cyclohexene-1-carbothioamide CAS Name: 2-[(4-methoxyphenyl)methylamino]-4,4-dimethyl-6-oxo-N-(4-phenoxyphenyl)-1-cyclohexenecarbothioamide IUPAC Name: 2-[(4-methoxyphenyl)methylamino]-4,4-dimethyl-6-oxo-N-(4-phenoxyphenyl)cyclohexene-1-carbothioamide Traditional Name: 6-keto-4,4-dimethyl-2-(p-anisylamino)-N-(4-phenoxyphenyl)cyclohexene-1-carbothioamide Formula: C29H30N2O3S MolecularWeight: 486.6251

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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)NCC4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C(=S)NC2=CC=C(C=C2)OC3=CC=CC=C3)NCC4=CC=C(C=C4)OC)C

InChI

InChI=1S/C29H30N2O3S/c1-29(2)17-25(30-19-20-9-13-22(33-3)14-10-20)27(26(32)18-29)28(35)31-21-11-15-24(16-12-21)34-23-7-5-4-6-8-23/h4-16,30H,17-19H2,1-3H3,(H,31,35)