2-(phenylmethyl)sulfonyl-1-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazole

Systemtic Name: 2-(phenylmethyl)sulfonyl-1-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazole Openeye Name: 2-benzylsulfonyl-1-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazole CAS Name: 2-(phenylmethyl)sulfonyl-1-[2-(1-pyrrolidin-1-iumyl)ethyl]benzimidazole IUPAC Name: 2-benzylsulfonyl-1-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazole Traditional Name: 2-benzylsulfonyl-1-(2-pyrrolidin-1-ium-1-ylethyl)benzimidazole Formula: C20H24N3O2S+ MolecularWeight: 370.48846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCN2C3=CC=CC=C3N=C2S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](C1)CCN2C3=CC=CC=C3N=C2S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C20H23N3O2S/c24-26(25,16-17-8-2-1-3-9-17)20-21-18-10-4-5-11-19(18)23(20)15-14-22-12-6-7-13-22/h1-5,8-11H,6-7,12-16H2/p+1