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

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-5-[(propan-2-ylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-5-[(isopropylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(3-chloro-4-fluorophenyl)-5-[(propan-2-ylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(3-chloro-4-fluorophenyl)-5-[(propan-2-ylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-5-[(isopropylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C14H13ClFN3O2S MolecularWeight: 341.788323

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC=C1C(=O)NC(=S)N(C1=O)C2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CC(C)NC=C1C(=O)NC(=S)N(C1=O)C2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C14H13ClFN3O2S/c1-7(2)17-6-9-12(20)18-14(22)19(13(9)21)8-3-4-11(16)10(15)5-8/h3-7,17H,1-2H3,(H,18,20,22)