(6E)-2-cyclohexylsulfanyl-5,5-dimethyl-6-(phenylmethylidene)-1H-pyrimidin-4-one

Systemtic Name: (6E)-2-cyclohexylsulfanyl-5,5-dimethyl-6-(phenylmethylidene)-1H-pyrimidin-4-one Openeye Name: (6E)-6-benzylidene-2-cyclohexylsulfanyl-5,5-dimethyl-1H-pyrimidin-4-one CAS Name: (6E)-2-(cyclohexylthio)-5,5-dimethyl-6-(phenylmethylene)-1H-pyrimidin-4-one IUPAC Name: (6E)-6-benzylidene-2-cyclohexylsulfanyl-5,5-dimethyl-1H-pyrimidin-4-one Traditional Name: (6E)-6-benzal-2-(cyclohexylthio)-5,5-dimethyl-1H-pyrimidin-4-one Formula: C19H24N2OS MolecularWeight: 328.47166

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=CC2=CC=CC=C2)NC(=NC1=O)SC3CCCCC3)C

Isomeric SMILES

CC1(/C(=C\C2=CC=CC=C2)/NC(=NC1=O)SC3CCCCC3)C

InChI

InChI=1S/C19H24N2OS/c1-19(2)16(13-14-9-5-3-6-10-14)20-18(21-17(19)22)23-15-11-7-4-8-12-15/h3,5-6,9-10,13,15H,4,7-8,11-12H2,1-2H3,(H,20,21,22)/b16-13+