3-[[4-propan-2-yl-6-(3-propan-2-ylphenoxy)pyrimidin-2-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 3-[[4-propan-2-yl-6-(3-propan-2-ylphenoxy)pyrimidin-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-[[4-isopropyl-6-(3-isopropylphenoxy)pyrimidin-2-yl]sulfanylmethyl]benzonitrile CAS Name: 3-[[[4-propan-2-yl-6-(3-propan-2-ylphenoxy)-2-pyrimidinyl]thio]methyl]benzonitrile IUPAC Name: 3-[[4-propan-2-yl-6-(3-propan-2-ylphenoxy)pyrimidin-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 3-[[[4-isopropyl-6-(3-isopropylphenoxy)pyrimidin-2-yl]thio]methyl]benzonitrile Formula: C24H25N3OS MolecularWeight: 403.5398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)OC2=NC(=NC(=C2)C(C)C)SCC3=CC=CC(=C3)C#N

Isomeric SMILES

CC(C)C1=CC(=CC=C1)OC2=NC(=NC(=C2)C(C)C)SCC3=CC=CC(=C3)C#N

InChI

InChI=1S/C24H25N3OS/c1-16(2)20-9-6-10-21(12-20)28-23-13-22(17(3)4)26-24(27-23)29-15-19-8-5-7-18(11-19)14-25/h5-13,16-17H,15H2,1-4H3