N-(2-morpholin-4-ium-4-ylethyl)-N-(1,3-thiazol-2-ylmethyl)quinoline-8-carboxamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-N-(1,3-thiazol-2-ylmethyl)quinoline-8-carboxamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-N-(thiazol-2-ylmethyl)quinoline-8-carboxamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-N-(2-thiazolylmethyl)-8-quinolinecarboxamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-N-(1,3-thiazol-2-ylmethyl)quinoline-8-carboxamide Traditional Name: N-(2-morpholin-4-ium-4-ylethyl)-N-(thiazol-2-ylmethyl)quinoline-8-carboxamide Formula: C20H23N4O2S+ MolecularWeight: 383.48722

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCN(CC2=NC=CS2)C(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1COCC[NH+]1CCN(CC2=NC=CS2)C(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C20H22N4O2S/c25-20(17-5-1-3-16-4-2-6-22-19(16)17)24(15-18-21-7-14-27-18)9-8-23-10-12-26-13-11-23/h1-7,14H,8-13,15H2/p+1