N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]-2,3-bis(oxidanylidene)-1,4-dihydroquinoxaline-6-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(CNC(=O)C2=CC3=C(C=C2)NC(=O)C(=O)N3)C4=CC=CS4

Isomeric SMILES

CC1CC[NH+](CC1)[C@H](CNC(=O)C2=CC3=C(C=C2)NC(=O)C(=O)N3)C4=CC=CS4

InChI

InChI=1S/C21H24N4O3S/c1-13-6-8-25(9-7-13)17(18-3-2-10-29-18)12-22-19(26)14-4-5-15-16(11-14)24-21(28)20(27)23-15/h2-5,10-11,13,17H,6-9,12H2,1H3,(H,22,26)(H,23,27)(H,24,28)/p+1/t17-/m1/s1