1-(2-azanylethyl)-4-piperidin-4-yl-1-(1,3-thiazol-4-ylmethyl)benzimidazol-1-ium-2-amine

Systemtic Name: 1-(2-azanylethyl)-4-piperidin-4-yl-1-(1,3-thiazol-4-ylmethyl)benzimidazol-1-ium-2-amine Openeye Name: 1-(2-aminoethyl)-4-(4-piperidyl)-1-(thiazol-4-ylmethyl)benzimidazol-1-ium-2-amine CAS Name: 1-(2-aminoethyl)-4-(4-piperidinyl)-1-(4-thiazolylmethyl)-2-benzimidazol-1-iumamine IUPAC Name: 1-(2-aminoethyl)-4-piperidin-4-yl-1-(1,3-thiazol-4-ylmethyl)benzimidazol-1-ium-2-amine Traditional Name: [1-(2-aminoethyl)-4-(4-piperidyl)-1-(thiazol-4-ylmethyl)benzimidazol-1-ium-2-yl]amine Formula: C18H25N6S+ MolecularWeight: 357.4963

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=C3C(=CC=C2)[N+](C(=N3)N)(CCN)CC4=CSC=N4

Isomeric SMILES

C1CNCCC1C2=C3C(=CC=C2)[N+](C(=N3)N)(CCN)CC4=CSC=N4

InChI

InChI=1S/C18H25N6S/c19-6-9-24(10-14-11-25-12-22-14)16-3-1-2-15(17(16)23-18(24)20)13-4-7-21-8-5-13/h1-3,11-13,21H,4-10,19H2,(H2,20,23)/q+1