2-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-(2,4,6-trimethylphenyl)propanamide

Systemtic Name: 2-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-(2,4,6-trimethylphenyl)propanamide Openeye Name: 2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-(2,4,6-trimethylphenyl)propanamide CAS Name: 2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)thio]-N-(2,4,6-trimethylphenyl)propanamide IUPAC Name: 2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-(2,4,6-trimethylphenyl)propanamide Traditional Name: 2-[(4-keto-6-phenyl-1H-pyrimidin-2-yl)thio]-N-mesityl-propionamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C(C)SC2=NC(=O)C=C(N2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C(C)SC2=NC(=O)C=C(N2)C3=CC=CC=C3)C

InChI

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