2-[(4-ethoxyphenyl)amino]-N-(2-pyrrolidin-1-ium-1-ylethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(4-ethoxyphenyl)amino]-N-(2-pyrrolidin-1-ium-1-ylethyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-(4-ethoxyanilino)-N-(2-pyrrolidin-1-ium-1-ylethyl)thiazole-4-carboxamide CAS Name: 2-(4-ethoxyanilino)-N-[2-(1-pyrrolidin-1-iumyl)ethyl]-4-thiazolecarboxamide IUPAC Name: 2-(4-ethoxyanilino)-N-(2-pyrrolidin-1-ium-1-ylethyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-(p-phenetidino)-N-(2-pyrrolidin-1-ium-1-ylethyl)thiazole-4-carboxamide Formula: C18H25N4O2S+ MolecularWeight: 361.4817

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC(=CS2)C(=O)NCC[NH+]3CCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC(=CS2)C(=O)NCC[NH+]3CCCC3

InChI

InChI=1S/C18H24N4O2S/c1-2-24-15-7-5-14(6-8-15)20-18-21-16(13-25-18)17(23)19-9-12-22-10-3-4-11-22/h5-8,13H,2-4,9-12H2,1H3,(H,19,23)(H,20,21)/p+1