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

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-5-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-(3-chloranyl-2-methyl-phenyl)ethanamide Openeye Name: 2-[(6-amino-4-oxo-5-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-(3-chloro-2-methyl-phenyl)acetamide CAS Name: 2-[(6-amino-4-oxo-5-phenyl-1H-pyrimidin-2-yl)thio]-N-(3-chloro-2-methylphenyl)acetamide IUPAC Name: 2-[(6-amino-4-oxo-5-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-(3-chloro-2-methylphenyl)acetamide Traditional Name: 2-[(6-amino-4-keto-5-phenyl-1H-pyrimidin-2-yl)thio]-N-(3-chloro-2-methyl-phenyl)acetamide Formula: C19H17ClN4O2S MolecularWeight: 400.88188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CSC2=NC(=O)C(=C(N2)N)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CSC2=NC(=O)C(=C(N2)N)C3=CC=CC=C3

InChI

InChI=1S/C19H17ClN4O2S/c1-11-13(20)8-5-9-14(11)22-15(25)10-27-19-23-17(21)16(18(26)24-19)12-6-3-2-4-7-12/h2-9H,10H2,1H3,(H,22,25)(H3,21,23,24,26)