2-[(6-azanyl-4-oxidanylidene-5-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-(3,5-dimethylphenyl)ethanamide

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-5-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-(3,5-dimethylphenyl)ethanamide Openeye Name: 2-[(6-amino-4-oxo-5-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-(3,5-dimethylphenyl)acetamide CAS Name: 2-[(6-amino-4-oxo-5-phenyl-1H-pyrimidin-2-yl)thio]-N-(3,5-dimethylphenyl)acetamide IUPAC Name: 2-[(6-amino-4-oxo-5-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-(3,5-dimethylphenyl)acetamide Traditional Name: 2-[(6-amino-4-keto-5-phenyl-1H-pyrimidin-2-yl)thio]-N-(3,5-dimethylphenyl)acetamide Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CSC2=NC(=O)C(=C(N2)N)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CSC2=NC(=O)C(=C(N2)N)C3=CC=CC=C3)C

InChI

InChI=1S/C20H20N4O2S/c1-12-8-13(2)10-15(9-12)22-16(25)11-27-20-23-18(21)17(19(26)24-20)14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H,22,25)(H3,21,23,24,26)