8-chloranyl-3-(4-ethylphenyl)-N-(2-morpholin-4-ium-4-ylethyl)thieno[3,2-c]quinoline-2-carboxamide

Systemtic Name: 8-chloranyl-3-(4-ethylphenyl)-N-(2-morpholin-4-ium-4-ylethyl)thieno[3,2-c]quinoline-2-carboxamide Openeye Name: 8-chloro-3-(4-ethylphenyl)-N-(2-morpholin-4-ium-4-ylethyl)thieno[3,2-c]quinoline-2-carboxamide CAS Name: 8-chloro-3-(4-ethylphenyl)-N-[2-(4-morpholin-4-iumyl)ethyl]-2-thieno[3,2-c]quinolinecarboxamide IUPAC Name: 8-chloro-3-(4-ethylphenyl)-N-(2-morpholin-4-ium-4-ylethyl)thieno[3,2-c]quinoline-2-carboxamide Traditional Name: 8-chloro-3-(4-ethylphenyl)-N-(2-morpholin-4-ium-4-ylethyl)thieno[3,2-c]quinoline-2-carboxamide Formula: C26H27ClN3O2S+ MolecularWeight: 481.02948

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(SC3=C4C=C(C=CC4=NC=C23)Cl)C(=O)NCC[NH+]5CCOCC5

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(SC3=C4C=C(C=CC4=NC=C23)Cl)C(=O)NCC[NH+]5CCOCC5

InChI

InChI=1S/C26H26ClN3O2S/c1-2-17-3-5-18(6-4-17)23-21-16-29-22-8-7-19(27)15-20(22)24(21)33-25(23)26(31)28-9-10-30-11-13-32-14-12-30/h3-8,15-16H,2,9-14H2,1H3,(H,28,31)/p+1