1-butan-2-yl-5-[[(4-fluorophenyl)methylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-butan-2-yl-5-[[(4-fluorophenyl)methylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[(4-fluorophenyl)methylamino]methylene]-1-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-butan-2-yl-5-[[(4-fluorophenyl)methylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-butan-2-yl-5-[[(4-fluorophenyl)methylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[[(4-fluorobenzyl)amino]methylene]-1-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C16H18FN3O2S MolecularWeight: 335.396423

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C(=CNCC2=CC=C(C=C2)F)C(=O)NC1=S

Isomeric SMILES

CCC(C)N1C(=O)C(=CNCC2=CC=C(C=C2)F)C(=O)NC1=S

InChI

InChI=1S/C16H18FN3O2S/c1-3-10(2)20-15(22)13(14(21)19-16(20)23)9-18-8-11-4-6-12(17)7-5-11/h4-7,9-10,18H,3,8H2,1-2H3,(H,19,21,23)