N-(4-ethanoylphenyl)-2-[(6-oxidanylidene-4-phenyl-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]propanamide

Systemtic Name: N-(4-ethanoylphenyl)-2-[(6-oxidanylidene-4-phenyl-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]propanamide Openeye Name: N-(4-acetylphenyl)-2-[(6-oxo-4-phenyl-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]propanamide CAS Name: N-(4-acetylphenyl)-2-[(6-oxo-4-phenyl-4,5-dihydro-1H-pyrimidin-2-yl)thio]propanamide IUPAC Name: N-(4-acetylphenyl)-2-[(6-oxo-4-phenyl-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]propanamide Traditional Name: N-(4-acetylphenyl)-2-[(6-keto-4-phenyl-4,5-dihydro-1H-pyrimidin-2-yl)thio]propionamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)C)SC2=NC(CC(=O)N2)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(=O)C)SC2=NC(CC(=O)N2)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3S/c1-13(25)15-8-10-17(11-9-15)22-20(27)14(2)28-21-23-18(12-19(26)24-21)16-6-4-3-5-7-16/h3-11,14,18H,12H2,1-2H3,(H,22,27)(H,23,24,26)