4-(3,4-dimethylphenoxy)-6-ethyl-2-[(4-fluorophenyl)methylsulfanyl]pyrimidine

Systemtic Name: 4-(3,4-dimethylphenoxy)-6-ethyl-2-[(4-fluorophenyl)methylsulfanyl]pyrimidine Openeye Name: 4-(3,4-dimethylphenoxy)-6-ethyl-2-[(4-fluorophenyl)methylsulfanyl]pyrimidine CAS Name: 4-(3,4-dimethylphenoxy)-6-ethyl-2-[(4-fluorophenyl)methylthio]pyrimidine IUPAC Name: 4-(3,4-dimethylphenoxy)-6-ethyl-2-[(4-fluorophenyl)methylsulfanyl]pyrimidine Traditional Name: 4-(3,4-dimethylphenoxy)-6-ethyl-2-[(4-fluorobenzyl)thio]pyrimidine Formula: C21H21FN2OS MolecularWeight: 368.467643

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=N1)SCC2=CC=C(C=C2)F)OC3=CC(=C(C=C3)C)C

Isomeric SMILES

CCC1=CC(=NC(=N1)SCC2=CC=C(C=C2)F)OC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C21H21FN2OS/c1-4-18-12-20(25-19-10-5-14(2)15(3)11-19)24-21(23-18)26-13-16-6-8-17(22)9-7-16/h5-12H,4,13H2,1-3H3