5-[(2R)-1-(isoquinolin-5-ylmethyl)pyrrolidin-1-ium-2-yl]-N-(2-methoxyethyl)thiophene-2-carboxamide

Systemtic Name: 5-[(2R)-1-(isoquinolin-5-ylmethyl)pyrrolidin-1-ium-2-yl]-N-(2-methoxyethyl)thiophene-2-carboxamide Openeye Name: 5-[(2R)-1-(5-isoquinolylmethyl)pyrrolidin-1-ium-2-yl]-N-(2-methoxyethyl)thiophene-2-carboxamide CAS Name: 5-[(2R)-1-(5-isoquinolinylmethyl)-2-pyrrolidin-1-iumyl]-N-(2-methoxyethyl)-2-thiophenecarboxamide IUPAC Name: 5-[(2R)-1-(isoquinolin-5-ylmethyl)pyrrolidin-1-ium-2-yl]-N-(2-methoxyethyl)thiophene-2-carboxamide Traditional Name: 5-[(2R)-1-(5-isoquinolylmethyl)pyrrolidin-1-ium-2-yl]-N-(2-methoxyethyl)thiophene-2-carboxamide Formula: C22H26N3O2S+ MolecularWeight: 396.52574

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C1=CC=C(S1)C2CCC[NH+]2CC3=CC=CC4=C3C=CN=C4

Isomeric SMILES

COCCNC(=O)C1=CC=C(S1)[C@H]2CCC[NH+]2CC3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C22H25N3O2S/c1-27-13-11-24-22(26)21-8-7-20(28-21)19-6-3-12-25(19)15-17-5-2-4-16-14-23-10-9-18(16)17/h2,4-5,7-10,14,19H,3,6,11-13,15H2,1H3,(H,24,26)/p+1/t19-/m1/s1