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

Systemtic Name: N-[2-(morpholin-4-ium-4-ylmethyl)-1-propyl-benzimidazol-5-yl]thiophene-2-carboxamide Openeye Name: N-[2-(morpholin-4-ium-4-ylmethyl)-1-propyl-benzimidazol-5-yl]thiophene-2-carboxamide CAS Name: N-[2-(4-morpholin-4-iumylmethyl)-1-propyl-5-benzimidazolyl]-2-thiophenecarboxamide IUPAC Name: N-[2-(morpholin-4-ium-4-ylmethyl)-1-propylbenzimidazol-5-yl]thiophene-2-carboxamide Traditional Name: N-[2-(morpholin-4-ium-4-ylmethyl)-1-propyl-benzimidazol-5-yl]thiophene-2-carboxamide Formula: C20H25N4O2S+ MolecularWeight: 385.5031

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)NC(=O)C3=CC=CS3)N=C1C[NH+]4CCOCC4

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)NC(=O)C3=CC=CS3)N=C1C[NH+]4CCOCC4

InChI

InChI=1S/C20H24N4O2S/c1-2-7-24-17-6-5-15(21-20(25)18-4-3-12-27-18)13-16(17)22-19(24)14-23-8-10-26-11-9-23/h3-6,12-13H,2,7-11,14H2,1H3,(H,21,25)/p+1