2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(4-phenoxyphenyl)butanamide

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(4-phenoxyphenyl)butanamide Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(4-phenoxyphenyl)butanamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-(4-phenoxyphenyl)butanamide IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(4-phenoxyphenyl)butanamide Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-(4-phenoxyphenyl)butyramide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)SC3=NC(=CC(=N3)C)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)SC3=NC(=CC(=N3)C)C

InChI

InChI=1S/C22H23N3O2S/c1-4-20(28-22-23-15(2)14-16(3)24-22)21(26)25-17-10-12-19(13-11-17)27-18-8-6-5-7-9-18/h5-14,20H,4H2,1-3H3,(H,25,26)