2-cyclohexylsulfanyl-5-methyl-6-phenethyl-1H-pyrimidin-4-one

Systemtic Name: 2-cyclohexylsulfanyl-5-methyl-6-phenethyl-1H-pyrimidin-4-one Openeye Name: 2-cyclohexylsulfanyl-5-methyl-6-phenethyl-1H-pyrimidin-4-one CAS Name: 2-(cyclohexylthio)-5-methyl-6-phenethyl-1H-pyrimidin-4-one IUPAC Name: 2-cyclohexylsulfanyl-5-methyl-6-phenethyl-1H-pyrimidin-4-one Traditional Name: 2-(cyclohexylthio)-5-methyl-6-phenethyl-1H-pyrimidin-4-one Formula: C19H24N2OS MolecularWeight: 328.47166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)SC2CCCCC2)CCC3=CC=CC=C3

Isomeric SMILES

CC1=C(NC(=NC1=O)SC2CCCCC2)CCC3=CC=CC=C3

InChI

InChI=1S/C19H24N2OS/c1-14-17(13-12-15-8-4-2-5-9-15)20-19(21-18(14)22)23-16-10-6-3-7-11-16/h2,4-5,8-9,16H,3,6-7,10-13H2,1H3,(H,20,21,22)