4-[2-(2-ethanoylphenoxy)ethylsulfanyl]-2,6-dimethyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-[2-(2-ethanoylphenoxy)ethylsulfanyl]-2,6-dimethyl-pyrimidine-5-carbonitrile Openeye Name: 4-[2-(2-acetylphenoxy)ethylsulfanyl]-2,6-dimethyl-pyrimidine-5-carbonitrile CAS Name: 4-[2-(2-acetylphenoxy)ethylthio]-2,6-dimethyl-5-pyrimidinecarbonitrile IUPAC Name: 4-[2-(2-acetylphenoxy)ethylsulfanyl]-2,6-dimethylpyrimidine-5-carbonitrile Traditional Name: 4-[2-(2-acetylphenoxy)ethylthio]-2,6-dimethyl-pyrimidine-5-carbonitrile Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)SCCOC2=CC=CC=C2C(=O)C)C#N

Isomeric SMILES

CC1=C(C(=NC(=N1)C)SCCOC2=CC=CC=C2C(=O)C)C#N

InChI

InChI=1S/C17H17N3O2S/c1-11-15(10-18)17(20-13(3)19-11)23-9-8-22-16-7-5-4-6-14(16)12(2)21/h4-7H,8-9H2,1-3H3