4-(3,5-dimethylphenoxy)-6-ethyl-2-(phenylmethylsulfanyl)pyrimidine

Systemtic Name: 4-(3,5-dimethylphenoxy)-6-ethyl-2-(phenylmethylsulfanyl)pyrimidine Openeye Name: 2-benzylsulfanyl-4-(3,5-dimethylphenoxy)-6-ethyl-pyrimidine CAS Name: 4-(3,5-dimethylphenoxy)-6-ethyl-2-(phenylmethylthio)pyrimidine IUPAC Name: 2-benzylsulfanyl-4-(3,5-dimethylphenoxy)-6-ethylpyrimidine Traditional Name: 2-(benzylthio)-4-(3,5-dimethylphenoxy)-6-ethyl-pyrimidine Formula: C21H22N2OS MolecularWeight: 350.47718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2OS/c1-4-18-13-20(24-19-11-15(2)10-16(3)12-19)23-21(22-18)25-14-17-8-6-5-7-9-17/h5-13H,4,14H2,1-3H3