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

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[2,6-bis(chloranyl)-3-methyl-phenyl]ethanamide Openeye Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(2,6-dichloro-3-methyl-phenyl)acetamide CAS Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-N-(2,6-dichloro-3-methylphenyl)acetamide IUPAC Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(2,6-dichloro-3-methylphenyl)acetamide Traditional Name: 2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-N-(2,6-dichloro-3-methyl-phenyl)acetamide Formula: C13H12Cl2N4O2S MolecularWeight: 359.23098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)Cl)NC(=O)CSC2=NC(=O)C=C(N2)N)Cl

Isomeric SMILES

CC1=C(C(=C(C=C1)Cl)NC(=O)CSC2=NC(=O)C=C(N2)N)Cl

InChI

InChI=1S/C13H12Cl2N4O2S/c1-6-2-3-7(14)12(11(6)15)18-10(21)5-22-13-17-8(16)4-9(20)19-13/h2-4H,5H2,1H3,(H,18,21)(H3,16,17,19,20)