1-(3-chloranyl-4-fluoranyl-phenyl)-5-[(1-phenylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-5-[(1-phenylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-5-[(1-phenylethylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(3-chloro-4-fluorophenyl)-5-[(1-phenylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(3-chloro-4-fluorophenyl)-5-[(1-phenylethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-5-[(1-phenylethylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C19H15ClFN3O2S MolecularWeight: 403.857703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC=C2C(=O)NC(=S)N(C2=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC(C1=CC=CC=C1)NC=C2C(=O)NC(=S)N(C2=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C19H15ClFN3O2S/c1-11(12-5-3-2-4-6-12)22-10-14-17(25)23-19(27)24(18(14)26)13-7-8-16(21)15(20)9-13/h2-11,22H,1H3,(H,23,25,27)