pyridin-3-ylmethyl-(quinolin-6-ylmethyl)-(thiophen-2-ylmethyl)azanium

Systemtic Name: pyridin-3-ylmethyl-(quinolin-6-ylmethyl)-(thiophen-2-ylmethyl)azanium Openeye Name: 3-pyridylmethyl-(6-quinolylmethyl)-(2-thienylmethyl)ammonium CAS Name: 3-pyridinylmethyl-(6-quinolinylmethyl)-(thiophen-2-ylmethyl)ammonium IUPAC Name: pyridin-3-ylmethyl-(quinolin-6-ylmethyl)-(thiophen-2-ylmethyl)azanium Traditional Name: 3-pyridylmethyl-(6-quinolylmethyl)-(2-thenyl)ammonium Formula: C21H20N3S+ MolecularWeight: 346.4686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)C[NH+](CC3=CN=CC=C3)CC4=CC=CS4)N=C1

Isomeric SMILES

C1=CC2=C(C=CC(=C2)C[NH+](CC3=CN=CC=C3)CC4=CC=CS4)N=C1

InChI

InChI=1S/C21H19N3S/c1-4-18(13-22-9-1)15-24(16-20-6-3-11-25-20)14-17-7-8-21-19(12-17)5-2-10-23-21/h1-13H,14-16H2/p+1