N-(2,4-dichlorophenyl)propanamide; 3-(4-fluorophenyl)-5-methylidene-2-sulfanyl-1H-pyrimidin-3-ium-4,6-dione

Systemtic Name: N-(2,4-dichlorophenyl)propanamide; 3-(4-fluorophenyl)-5-methylidene-2-sulfanyl-1H-pyrimidin-3-ium-4,6-dione Openeye Name: N-(2,4-dichlorophenyl)propanamide; 3-(4-fluorophenyl)-5-methylene-2-sulfanyl-1H-pyrimidin-3-ium-4,6-dione CAS Name: N-(2,4-dichlorophenyl)propanamide; 3-(4-fluorophenyl)-2-mercapto-5-methylene-1H-pyrimidin-3-ium-4,6-dione IUPAC Name: N-(2,4-dichlorophenyl)propanamide; 3-(4-fluorophenyl)-5-methylidene-2-sulfanyl-1H-pyrimidin-3-ium-4,6-dione Traditional Name: N-(2,4-dichlorophenyl)propionamide; 3-(4-fluorophenyl)-2-mercapto-5-methylene-1H-pyrimidin-3-ium-4,6-quinone Formula: C20H17Cl2FN3O3S+ MolecularWeight: 469.336683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=C(C=C1)Cl)Cl.C=C1C(=O)NC(=[N+](C1=O)C2=CC=C(C=C2)F)S

Isomeric SMILES

CCC(=O)NC1=C(C=C(C=C1)Cl)Cl.C=C1C(=O)NC(=[N+](C1=O)C2=CC=C(C=C2)F)S

InChI

InChI=1S/C11H7FN2O2S.C9H9Cl2NO/c1-6-9(15)13-11(17)14(10(6)16)8-4-2-7(12)3-5-8;1-2-9(13)12-8-4-3-6(10)5-7(8)11/h2-5H,1H2,(H,13,15,17);3-5H,2H2,1H3,(H,12,13)/p+1