5-[(4-cyclohexylphenyl)methyl]-6-methyl-2-(2-methylpropylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 5-[(4-cyclohexylphenyl)methyl]-6-methyl-2-(2-methylpropylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 5-[(4-cyclohexylphenyl)methyl]-2-isobutylsulfanyl-6-methyl-1H-pyrimidin-4-one CAS Name: 5-[(4-cyclohexylphenyl)methyl]-6-methyl-2-(2-methylpropylthio)-1H-pyrimidin-4-one IUPAC Name: 5-[(4-cyclohexylphenyl)methyl]-6-methyl-2-(2-methylpropylsulfanyl)-1H-pyrimidin-4-one Traditional Name: 5-(4-cyclohexylbenzyl)-2-(isobutylthio)-6-methyl-1H-pyrimidin-4-one Formula: C22H30N2OS MolecularWeight: 370.5514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC(C)C)CC2=CC=C(C=C2)C3CCCCC3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC(C)C)CC2=CC=C(C=C2)C3CCCCC3

InChI

InChI=1S/C22H30N2OS/c1-15(2)14-26-22-23-16(3)20(21(25)24-22)13-17-9-11-19(12-10-17)18-7-5-4-6-8-18/h9-12,15,18H,4-8,13-14H2,1-3H3,(H,23,24,25)