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

Systemtic Name: 2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-N-(4-phenoxyphenyl)propanamide Openeye Name: 2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-N-(4-phenoxyphenyl)propanamide CAS Name: 2-[(2,6-dimethyl-4-pyrimidinyl)thio]-N-(4-phenoxyphenyl)propanamide IUPAC Name: 2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-N-(4-phenoxyphenyl)propanamide Traditional Name: 2-[(2,6-dimethylpyrimidin-4-yl)thio]-N-(4-phenoxyphenyl)propionamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C)SC(C)C(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NC(=N1)C)SC(C)C(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2S/c1-14-13-20(23-16(3)22-14)27-15(2)21(25)24-17-9-11-19(12-10-17)26-18-7-5-4-6-8-18/h4-13,15H,1-3H3,(H,24,25)