2-(6-phenylpyrimidin-4-yl)sulfanyl-N-(2-propan-2-ylphenyl)butanamide

Systemtic Name: 2-(6-phenylpyrimidin-4-yl)sulfanyl-N-(2-propan-2-ylphenyl)butanamide Openeye Name: N-(2-isopropylphenyl)-2-(6-phenylpyrimidin-4-yl)sulfanyl-butanamide CAS Name: 2-[(6-phenyl-4-pyrimidinyl)thio]-N-(2-propan-2-ylphenyl)butanamide IUPAC Name: 2-(6-phenylpyrimidin-4-yl)sulfanyl-N-(2-propan-2-ylphenyl)butanamide Traditional Name: N-o-cumenyl-2-[(6-phenylpyrimidin-4-yl)thio]butyramide Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C(C)C)SC2=NC=NC(=C2)C3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C(C)C)SC2=NC=NC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H25N3OS/c1-4-21(23(27)26-19-13-9-8-12-18(19)16(2)3)28-22-14-20(24-15-25-22)17-10-6-5-7-11-17/h5-16,21H,4H2,1-3H3,(H,26,27)