methyl-(quinolin-8-ylmethyl)-[[3-[2-(thiophen-2-ylcarbonylamino)ethoxy]phenyl]methyl]azanium

Systemtic Name: methyl-(quinolin-8-ylmethyl)-[[3-[2-(thiophen-2-ylcarbonylamino)ethoxy]phenyl]methyl]azanium Openeye Name: methyl-(8-quinolylmethyl)-[[3-[2-(thiophene-2-carbonylamino)ethoxy]phenyl]methyl]ammonium CAS Name: methyl-[[3-[2-[[oxo(thiophen-2-yl)methyl]amino]ethoxy]phenyl]methyl]-(8-quinolinylmethyl)ammonium IUPAC Name: methyl-(quinolin-8-ylmethyl)-[[3-[2-(thiophene-2-carbonylamino)ethoxy]phenyl]methyl]azanium Traditional Name: methyl-(8-quinolylmethyl)-[3-[2-(2-thenoylamino)ethoxy]benzyl]ammonium Formula: C25H26N3O2S+ MolecularWeight: 432.55784

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=CC=C1)OCCNC(=O)C2=CC=CS2)CC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C[NH+](CC1=CC(=CC=C1)OCCNC(=O)C2=CC=CS2)CC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C25H25N3O2S/c1-28(18-21-8-3-7-20-9-4-12-26-24(20)21)17-19-6-2-10-22(16-19)30-14-13-27-25(29)23-11-5-15-31-23/h2-12,15-16H,13-14,17-18H2,1H3,(H,27,29)/p+1