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

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-5-[(quinolin-6-ylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-5-[(6-quinolylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(3-chloro-4-fluorophenyl)-5-[(6-quinolinylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(3-chloro-4-fluorophenyl)-5-[(quinolin-6-ylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-5-[(6-quinolylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H12ClFN4O2S MolecularWeight: 426.851283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)NC=C3C(=O)NC(=S)N(C3=O)C4=CC(=C(C=C4)F)Cl)N=C1

Isomeric SMILES

C1=CC2=C(C=CC(=C2)NC=C3C(=O)NC(=S)N(C3=O)C4=CC(=C(C=C4)F)Cl)N=C1

InChI

InChI=1S/C20H12ClFN4O2S/c21-15-9-13(4-5-16(15)22)26-19(28)14(18(27)25-20(26)29)10-24-12-3-6-17-11(8-12)2-1-7-23-17/h1-10,24H,(H,25,27,29)