N-(2-morpholin-4-ium-4-ylethyl)-3-oxidanylidene-2,4-dihydroquinoxaline-1-carbothioamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-3-oxidanylidene-2,4-dihydroquinoxaline-1-carbothioamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-3-oxo-2,4-dihydroquinoxaline-1-carbothioamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-3-oxo-2,4-dihydroquinoxaline-1-carbothioamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-3-oxo-2,4-dihydroquinoxaline-1-carbothioamide Traditional Name: 3-keto-N-(2-morpholin-4-ium-4-ylethyl)-2,4-dihydroquinoxaline-1-carbothioamide Formula: C15H21N4O2S+ MolecularWeight: 321.41784

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=S)N2CC(=O)NC3=CC=CC=C32

Isomeric SMILES

C1COCC[NH+]1CCNC(=S)N2CC(=O)NC3=CC=CC=C32

InChI

InChI=1S/C15H20N4O2S/c20-14-11-19(13-4-2-1-3-12(13)17-14)15(22)16-5-6-18-7-9-21-10-8-18/h1-4H,5-11H2,(H,16,22)(H,17,20)/p+1