5-[(2-tert-butylsulfanylethylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(2-tert-butylsulfanylethylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-allyl-5-[(2-tert-butylsulfanylethylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[2-(tert-butylthio)ethylamino]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(2-tert-butylsulfanylethylamino)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-allyl-5-[[2-(tert-butylthio)ethylamino]methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C14H21N3O2S2 MolecularWeight: 327.46544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O2S2/c1-5-7-17-12(19)10(11(18)16-13(17)20)9-15-6-8-21-14(2,3)4/h5,9,15H,1,6-8H2,2-4H3,(H,16,18,20)