5-pentyl-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-pentyl-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-pentyl-1-phenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-pentyl-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-pentyl-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-amyl-1-phenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C15H18N2O2S MolecularWeight: 290.38062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(=O)NC(=S)N(C1=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCC1C(=O)NC(=S)N(C1=O)C2=CC=CC=C2

InChI

InChI=1S/C15H18N2O2S/c1-2-3-5-10-12-13(18)16-15(20)17(14(12)19)11-8-6-4-7-9-11/h4,6-9,12H,2-3,5,10H2,1H3,(H,16,18,20)