N-(4-acetamidophenyl)-2-[2-[(3-chlorophenyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]ethanamide

Systemtic Name: N-(4-acetamidophenyl)-2-[2-[(3-chlorophenyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]ethanamide Openeye Name: N-(4-acetamidophenyl)-2-[2-[(3-chlorophenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetamide CAS Name: N-(4-acetamidophenyl)-2-[2-[(3-chlorophenyl)methylthio]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetamide IUPAC Name: N-(4-acetamidophenyl)-2-[2-[(3-chlorophenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetamide Traditional Name: N-(4-acetamidophenyl)-2-[2-[(3-chlorobenzyl)thio]-4-keto-6-methyl-1H-pyrimidin-5-yl]acetamide Formula: C22H21ClN4O3S MolecularWeight: 456.94514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CC(=CC=C2)Cl)CC(=O)NC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CC(=CC=C2)Cl)CC(=O)NC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C22H21ClN4O3S/c1-13-19(11-20(29)26-18-8-6-17(7-9-18)25-14(2)28)21(30)27-22(24-13)31-12-15-4-3-5-16(23)10-15/h3-10H,11-12H2,1-2H3,(H,25,28)(H,26,29)(H,24,27,30)