4-[2-[(4-chlorophenyl)methylsulfanyl]-6-(3-methylphenyl)pyrimidin-4-yl]morpholine

Systemtic Name: 4-[2-[(4-chlorophenyl)methylsulfanyl]-6-(3-methylphenyl)pyrimidin-4-yl]morpholine Openeye Name: 4-[2-[(4-chlorophenyl)methylsulfanyl]-6-(m-tolyl)pyrimidin-4-yl]morpholine CAS Name: 4-[2-[(4-chlorophenyl)methylthio]-6-(3-methylphenyl)-4-pyrimidinyl]morpholine IUPAC Name: 4-[2-[(4-chlorophenyl)methylsulfanyl]-6-(3-methylphenyl)pyrimidin-4-yl]morpholine Traditional Name: 4-[2-[(4-chlorobenzyl)thio]-6-(m-tolyl)pyrimidin-4-yl]morpholine Formula: C22H22ClN3OS MolecularWeight: 411.94758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CC(=NC(=N2)SCC3=CC=C(C=C3)Cl)N4CCOCC4

Isomeric SMILES

CC1=CC=CC(=C1)C2=CC(=NC(=N2)SCC3=CC=C(C=C3)Cl)N4CCOCC4

InChI

InChI=1S/C22H22ClN3OS/c1-16-3-2-4-18(13-16)20-14-21(26-9-11-27-12-10-26)25-22(24-20)28-15-17-5-7-19(23)8-6-17/h2-8,13-14H,9-12,15H2,1H3