N-[1-ethyl-2-(morpholin-4-ium-4-ylmethyl)benzimidazol-5-yl]thiophene-2-carboxamide

Systemtic Name: N-[1-ethyl-2-(morpholin-4-ium-4-ylmethyl)benzimidazol-5-yl]thiophene-2-carboxamide Openeye Name: N-[1-ethyl-2-(morpholin-4-ium-4-ylmethyl)benzimidazol-5-yl]thiophene-2-carboxamide CAS Name: N-[1-ethyl-2-(4-morpholin-4-iumylmethyl)-5-benzimidazolyl]-2-thiophenecarboxamide IUPAC Name: N-[1-ethyl-2-(morpholin-4-ium-4-ylmethyl)benzimidazol-5-yl]thiophene-2-carboxamide Traditional Name: N-[1-ethyl-2-(morpholin-4-ium-4-ylmethyl)benzimidazol-5-yl]thiophene-2-carboxamide Formula: C19H23N4O2S+ MolecularWeight: 371.47652

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C3=CC=CS3)N=C1C[NH+]4CCOCC4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C3=CC=CS3)N=C1C[NH+]4CCOCC4

InChI

InChI=1S/C19H22N4O2S/c1-2-23-16-6-5-14(20-19(24)17-4-3-11-26-17)12-15(16)21-18(23)13-22-7-9-25-10-8-22/h3-6,11-12H,2,7-10,13H2,1H3,(H,20,24)/p+1