2-[(4-chlorophenyl)methylsulfanyl]-6-methyl-5-(phenoxymethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-methyl-5-(phenoxymethyl)-1H-pyrimidin-4-one Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-methyl-5-(phenoxymethyl)-1H-pyrimidin-4-one CAS Name: 2-[(4-chlorophenyl)methylthio]-6-methyl-5-(phenoxymethyl)-1H-pyrimidin-4-one IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-methyl-5-(phenoxymethyl)-1H-pyrimidin-4-one Traditional Name: 2-[(4-chlorobenzyl)thio]-6-methyl-5-(phenoxymethyl)-1H-pyrimidin-4-one Formula: C19H17ClN2O2S MolecularWeight: 372.86848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CC=C(C=C2)Cl)COC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CC=C(C=C2)Cl)COC3=CC=CC=C3

InChI

InChI=1S/C19H17ClN2O2S/c1-13-17(11-24-16-5-3-2-4-6-16)18(23)22-19(21-13)25-12-14-7-9-15(20)10-8-14/h2-10H,11-12H2,1H3,(H,21,22,23)