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

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]ethanamide Openeye Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[3-chloro-5-(trifluoromethyl)-2-pyridyl]acetamide CAS Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]acetamide IUPAC Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]acetamide Traditional Name: 2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-N-[3-chloro-5-(trifluoromethyl)-2-pyridyl]acetamide Formula: C12H9ClF3N5O2S MolecularWeight: 379.74537

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NC(=C1Cl)NC(=O)CSC2=NC(=O)C=C(N2)N)C(F)(F)F

Isomeric SMILES

C1=C(C=NC(=C1Cl)NC(=O)CSC2=NC(=O)C=C(N2)N)C(F)(F)F

InChI

InChI=1S/C12H9ClF3N5O2S/c13-6-1-5(12(14,15)16)3-18-10(6)20-9(23)4-24-11-19-7(17)2-8(22)21-11/h1-3H,4H2,(H,18,20,23)(H3,17,19,21,22)