1-[4-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]-1,3-thiazol-2-yl]pyrrolidin-2-one

Systemtic Name: 1-[4-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]-1,3-thiazol-2-yl]pyrrolidin-2-one Openeye Name: 1-[4-[2-(4-benzylpiperazin-4-ium-1-yl)-2-oxo-ethyl]thiazol-2-yl]pyrrolidin-2-one CAS Name: 1-[4-[2-oxo-2-[4-(phenylmethyl)-1-piperazin-4-iumyl]ethyl]-2-thiazolyl]-2-pyrrolidinone IUPAC Name: 1-[4-[2-(4-benzylpiperazin-4-ium-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]pyrrolidin-2-one Traditional Name: 1-[4-[2-(4-benzylpiperazin-4-ium-1-yl)-2-keto-ethyl]thiazol-2-yl]-2-pyrrolidone Formula: C20H25N4O2S+ MolecularWeight: 385.5031

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=NC(=CS2)CC(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CC(=O)N(C1)C2=NC(=CS2)CC(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C20H24N4O2S/c25-18-7-4-8-24(18)20-21-17(15-27-20)13-19(26)23-11-9-22(10-12-23)14-16-5-2-1-3-6-16/h1-3,5-6,15H,4,7-14H2/p+1