N-(4-methoxy-2,5-dimethyl-phenyl)-2-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-methoxy-2,5-dimethyl-phenyl)-2-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-(4-methoxy-2,5-dimethyl-phenyl)-2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-(4-methoxy-2,5-dimethylphenyl)-2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: N-(4-methoxy-2,5-dimethylphenyl)-2-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: 2-[(4-keto-6-phenyl-1H-pyrimidin-2-yl)thio]-N-(4-methoxy-2,5-dimethyl-phenyl)acetamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1OC)C)NC(=O)CSC2=NC(=O)C=C(N2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1OC)C)NC(=O)CSC2=NC(=O)C=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3S/c1-13-10-18(27-3)14(2)9-16(13)22-20(26)12-28-21-23-17(11-19(25)24-21)15-7-5-4-6-8-15/h4-11H,12H2,1-3H3,(H,22,26)(H,23,24,25)