5-(carbamothioylamino)-1-ethyl-imidazol-1-ium-1-carboxamide

Systemtic Name: 5-(carbamothioylamino)-1-ethyl-imidazol-1-ium-1-carboxamide Openeye Name: 5-(carbamothioylamino)-1-ethyl-imidazol-1-ium-1-carboxamide CAS Name: 5-(carbamothioylamino)-1-ethyl-1-imidazol-1-iumcarboxamide IUPAC Name: 5-(carbamothioylamino)-1-ethylimidazol-1-ium-1-carboxamide Traditional Name: 1-ethyl-5-thioureido-imidazol-1-ium-1-carboxamide Formula: C7H12N5OS+ MolecularWeight: 214.26808

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C=NC=C1NC(=S)N)C(=O)N

Isomeric SMILES

CC[N+]1(C=NC=C1NC(=S)N)C(=O)N

InChI

InChI=1S/C7H11N5OS/c1-2-12(7(9)13)4-10-3-5(12)11-6(8)14/h3-4H,2H2,1H3,(H4-,8,9,11,13,14)/p+1