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

Systemtic Name: 1-butan-2-yl-5-[(hexylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(hexylamino)methylene]-1-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-butan-2-yl-5-[(hexylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-butan-2-yl-5-[(hexylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(hexylamino)methylene]-1-sec-butyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C15H25N3O2S MolecularWeight: 311.4429

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC=C1C(=O)NC(=S)N(C1=O)C(C)CC

Isomeric SMILES

CCCCCCNC=C1C(=O)NC(=S)N(C1=O)C(C)CC

InChI

InChI=1S/C15H25N3O2S/c1-4-6-7-8-9-16-10-12-13(19)17-15(21)18(14(12)20)11(3)5-2/h10-11,16H,4-9H2,1-3H3,(H,17,19,21)