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

Systemtic Name: 2-[(4-methoxyphenyl)methylamino]-4,4-dimethyl-6-oxidanylidene-N-phenyl-cyclohexene-1-carbothioamide Openeye Name: 2-[(4-methoxyphenyl)methylamino]-4,4-dimethyl-6-oxo-N-phenyl-cyclohexene-1-carbothioamide CAS Name: 2-[(4-methoxyphenyl)methylamino]-4,4-dimethyl-6-oxo-N-phenyl-1-cyclohexenecarbothioamide IUPAC Name: 2-[(4-methoxyphenyl)methylamino]-4,4-dimethyl-6-oxo-N-phenylcyclohexene-1-carbothioamide Traditional Name: 6-keto-4,4-dimethyl-2-(p-anisylamino)-N-phenyl-cyclohexene-1-carbothioamide Formula: C23H26N2O2S MolecularWeight: 394.52974

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C(=S)NC2=CC=CC=C2)NCC3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C(=S)NC2=CC=CC=C2)NCC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C23H26N2O2S/c1-23(2)13-19(24-15-16-9-11-18(27-3)12-10-16)21(20(26)14-23)22(28)25-17-7-5-4-6-8-17/h4-12,24H,13-15H2,1-3H3,(H,25,28)