1-[2-[[4-phenyl-5-(piperidin-1-ium-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]imidazolidin-2-one

Systemtic Name: 1-[2-[[4-phenyl-5-(piperidin-1-ium-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]imidazolidin-2-one Openeye Name: 1-[2-[[4-phenyl-5-(piperidin-1-ium-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]imidazolidin-2-one CAS Name: 1-[1-oxo-2-[[4-phenyl-5-(1-piperidin-1-iumylmethyl)-1,2,4-triazol-3-yl]thio]ethyl]-2-imidazolidinone IUPAC Name: 1-[2-[[4-phenyl-5-(piperidin-1-ium-1-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]imidazolidin-2-one Traditional Name: 1-[2-[[4-phenyl-5-(piperidin-1-ium-1-ylmethyl)-1,2,4-triazol-3-yl]thio]acetyl]-2-imidazolidinone Formula: C19H25N6O2S+ MolecularWeight: 401.5058

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=NN=C(N2C3=CC=CC=C3)SCC(=O)N4CCNC4=O

Isomeric SMILES

C1CC[NH+](CC1)CC2=NN=C(N2C3=CC=CC=C3)SCC(=O)N4CCNC4=O

InChI

InChI=1S/C19H24N6O2S/c26-17(24-12-9-20-18(24)27)14-28-19-22-21-16(13-23-10-5-2-6-11-23)25(19)15-7-3-1-4-8-15/h1,3-4,7-8H,2,5-6,9-14H2,(H,20,27)/p+1