(5Z)-5-[(3-fluoranyl-4-pyrrolidin-1-yl-phenyl)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5Z)-5-[(3-fluoranyl-4-pyrrolidin-1-yl-phenyl)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5Z)-1-allyl-5-[(3-fluoro-4-pyrrolidin-1-yl-phenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5Z)-5-[[3-fluoro-4-(1-pyrrolidinyl)phenyl]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5Z)-5-[(3-fluoro-4-pyrrolidin-1-ylphenyl)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5Z)-1-allyl-5-(3-fluoro-4-pyrrolidino-benzylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C18H18FN3O2S MolecularWeight: 359.417823

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C(=CC2=CC(=C(C=C2)N3CCCC3)F)C(=O)NC1=S

Isomeric SMILES

C=CCN1C(=O)/C(=C\C2=CC(=C(C=C2)N3CCCC3)F)/C(=O)NC1=S

InChI

InChI=1S/C18H18FN3O2S/c1-2-7-22-17(24)13(16(23)20-18(22)25)10-12-5-6-15(14(19)11-12)21-8-3-4-9-21/h2,5-6,10-11H,1,3-4,7-9H2,(H,20,23,25)/b13-10-