2-[[1-(quinolin-8-ylmethyl)benzimidazol-2-yl]amino]propyl methanesulfonate

Systemtic Name: 2-[[1-(quinolin-8-ylmethyl)benzimidazol-2-yl]amino]propyl methanesulfonate Openeye Name: 2-[[1-(8-quinolylmethyl)benzimidazol-2-yl]amino]propyl methanesulfonate CAS Name: methanesulfonic acid 2-[[1-(8-quinolinylmethyl)-2-benzimidazolyl]amino]propyl ester IUPAC Name: 2-[[1-(quinolin-8-ylmethyl)benzimidazol-2-yl]amino]propyl methanesulfonate Traditional Name: methanesulfonic acid 2-[[1-(8-quinolylmethyl)benzimidazol-2-yl]amino]propyl ester Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC(COS(=O)(=O)C)NC1=NC2=CC=CC=C2N1CC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC(COS(=O)(=O)C)NC1=NC2=CC=CC=C2N1CC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H22N4O3S/c1-15(14-28-29(2,26)27)23-21-24-18-10-3-4-11-19(18)25(21)13-17-8-5-7-16-9-6-12-22-20(16)17/h3-12,15H,13-14H2,1-2H3,(H,23,24)