N-tert-butyl-2-[4-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylethanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylethanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylacetyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[2-[[1-(2-methoxyethyl)-2-benzimidazolyl]thio]-1-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylacetyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[2-[[1-(2-methoxyethyl)benzimidazol-2-yl]thio]acetyl]piperazin-1-ium-1-yl]acetamide Formula: C22H34N5O3S+ MolecularWeight: 448.60206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C[NH+]1CCN(CC1)C(=O)CSC2=NC3=CC=CC=C3N2CCOC

Isomeric SMILES

CC(C)(C)NC(=O)C[NH+]1CCN(CC1)C(=O)CSC2=NC3=CC=CC=C3N2CCOC

InChI

InChI=1S/C22H33N5O3S/c1-22(2,3)24-19(28)15-25-9-11-26(12-10-25)20(29)16-31-21-23-17-7-5-6-8-18(17)27(21)13-14-30-4/h5-8H,9-16H2,1-4H3,(H,24,28)/p+1