[azanyl-[[5-(6-ethoxy-6-oxidanylidene-hexanoyl)-2-oxidanylidene-1,3-dihydroimidazol-4-yl]methylsulfanyl]methylidene]azanium

Systemtic Name: [azanyl-[[5-(6-ethoxy-6-oxidanylidene-hexanoyl)-2-oxidanylidene-1,3-dihydroimidazol-4-yl]methylsulfanyl]methylidene]azanium Openeye Name: [amino-[[5-(6-ethoxy-6-oxo-hexanoyl)-2-oxo-1,3-dihydroimidazol-4-yl]methylsulfanyl]methylene]ammonium CAS Name: [amino-[[5-(6-ethoxy-1,6-dioxohexyl)-2-oxo-1,3-dihydroimidazol-4-yl]methylthio]methylidene]ammonium IUPAC Name: [amino-[[5-(6-ethoxy-6-oxohexanoyl)-2-oxo-1,3-dihydroimidazol-4-yl]methylsulfanyl]methylidene]azanium Traditional Name: [amino-[[5-(6-ethoxy-6-keto-hexanoyl)-2-keto-4-imidazolin-4-yl]methylthio]methylene]ammonium Formula: C13H21N4O4S+ MolecularWeight: 329.39524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCC(=O)C1=C(NC(=O)N1)CSC(=[NH2+])N

Isomeric SMILES

CCOC(=O)CCCCC(=O)C1=C(NC(=O)N1)CSC(=[NH2+])N

InChI

InChI=1S/C13H20N4O4S/c1-2-21-10(19)6-4-3-5-9(18)11-8(7-22-12(14)15)16-13(20)17-11/h2-7H2,1H3,(H3,14,15)(H2,16,17,20)/p+1