1-ethyl-2,3-bis(oxidanylidene)-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]-4H-quinoxaline-6-carboxamide

Systemtic Name: 1-ethyl-2,3-bis(oxidanylidene)-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]-4H-quinoxaline-6-carboxamide Openeye Name: 1-ethyl-2,3-dioxo-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]-4H-quinoxaline-6-carboxamide CAS Name: 1-ethyl-2,3-dioxo-N-[(2S)-2-(1-pyrrolidin-1-iumyl)-2-thiophen-2-ylethyl]-4H-quinoxaline-6-carboxamide IUPAC Name: 1-ethyl-2,3-dioxo-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-ylethyl]-4H-quinoxaline-6-carboxamide Traditional Name: 1-ethyl-2,3-diketo-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]-4H-quinoxaline-6-carboxamide Formula: C21H25N4O3S+ MolecularWeight: 413.5132

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NCC(C3=CC=CS3)[NH+]4CCCC4)NC(=O)C1=O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NC[C@@H](C3=CC=CS3)[NH+]4CCCC4)NC(=O)C1=O

InChI

InChI=1S/C21H24N4O3S/c1-2-25-16-8-7-14(12-15(16)23-20(27)21(25)28)19(26)22-13-17(18-6-5-11-29-18)24-9-3-4-10-24/h5-8,11-12,17H,2-4,9-10,13H2,1H3,(H,22,26)(H,23,27)/p+1/t17-/m0/s1