2-[6-azanyl-1-(4-chlorophenyl)-4-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-[2-chloranyl-4-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[6-azanyl-1-(4-chlorophenyl)-4-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-[2-chloranyl-4-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[6-amino-1-(4-chlorophenyl)-4-oxo-pyrimidin-2-yl]sulfanyl-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[[6-amino-1-(4-chlorophenyl)-4-oxo-2-pyrimidinyl]thio]-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[6-amino-1-(4-chlorophenyl)-4-oxopyrimidin-2-yl]sulfanyl-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[[6-amino-1-(4-chlorophenyl)-4-keto-pyrimidin-2-yl]thio]-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide Formula: C19H13Cl2F3N4O2S MolecularWeight: 489.29833

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=CC(=O)N=C2SCC(=O)NC3=C(C=C(C=C3)C(F)(F)F)Cl)N)Cl

Isomeric SMILES

C1=CC(=CC=C1N2C(=CC(=O)N=C2SCC(=O)NC3=C(C=C(C=C3)C(F)(F)F)Cl)N)Cl

InChI

InChI=1S/C19H13Cl2F3N4O2S/c20-11-2-4-12(5-3-11)28-15(25)8-16(29)27-18(28)31-9-17(30)26-14-6-1-10(7-13(14)21)19(22,23)24/h1-8H,9,25H2,(H,26,30)