(5Z)-1-cyclohexyl-5-[(3-piperidin-1-ium-1-ylpropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5Z)-1-cyclohexyl-5-[(3-piperidin-1-ium-1-ylpropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5Z)-1-cyclohexyl-5-[(3-piperidin-1-ium-1-ylpropylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5Z)-1-cyclohexyl-5-[[3-(1-piperidin-1-iumyl)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5Z)-1-cyclohexyl-5-[(3-piperidin-1-ium-1-ylpropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5Z)-1-cyclohexyl-5-[(3-piperidin-1-ium-1-ylpropylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C19H31N4O2S+ MolecularWeight: 379.54004

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C(=CNCCC[NH+]3CCCCC3)C(=O)NC2=S

Isomeric SMILES

C1CCC(CC1)N2C(=O)/C(=C\NCCC[NH+]3CCCCC3)/C(=O)NC2=S

InChI

InChI=1S/C19H30N4O2S/c24-17-16(14-20-10-7-13-22-11-5-2-6-12-22)18(25)23(19(26)21-17)15-8-3-1-4-9-15/h14-15,20H,1-13H2,(H,21,24,26)/p+1/b16-14-