(5R)-5-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-4-ium-1-yl]carbonylpyrrolidin-2-one

Systemtic Name: (5R)-5-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-4-ium-1-yl]carbonylpyrrolidin-2-one Openeye Name: (5R)-5-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-4-ium-1-carbonyl]pyrrolidin-2-one CAS Name: (5R)-5-[[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazin-4-iumyl]-oxomethyl]-2-pyrrolidinone IUPAC Name: (5R)-5-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-4-ium-1-carbonyl]pyrrolidin-2-one Traditional Name: (5R)-5-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-4-ium-1-carbonyl]-2-pyrrolidone Formula: C17H21N4O2S+ MolecularWeight: 345.43924

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC1C(=O)N2CC[NH+](CC2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC(=O)N[C@H]1C(=O)N2CC[NH+](CC2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H20N4O2S/c22-15-6-5-13(18-15)17(23)21-9-7-20(8-10-21)11-16-19-12-3-1-2-4-14(12)24-16/h1-4,13H,5-11H2,(H,18,22)/p+1/t13-/m1/s1