2-[(2R)-1-(2,2-diphenylethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-N-(1,3-thiazol-2-ylmethyl)ethanamide

Systemtic Name: 2-[(2R)-1-(2,2-diphenylethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-N-(1,3-thiazol-2-ylmethyl)ethanamide Openeye Name: 2-[(2R)-1-(2,2-diphenylethyl)-3-oxo-piperazin-1-ium-2-yl]-N-methyl-N-(thiazol-2-ylmethyl)acetamide CAS Name: 2-[(2R)-1-(2,2-diphenylethyl)-3-oxo-2-piperazin-1-iumyl]-N-methyl-N-(2-thiazolylmethyl)acetamide IUPAC Name: 2-[(2R)-1-(2,2-diphenylethyl)-3-oxopiperazin-1-ium-2-yl]-N-methyl-N-(1,3-thiazol-2-ylmethyl)acetamide Traditional Name: 2-[(2R)-1-(2,2-diphenylethyl)-3-keto-piperazin-1-ium-2-yl]-N-methyl-N-(thiazol-2-ylmethyl)acetamide Formula: C25H29N4O2S+ MolecularWeight: 449.58836

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC=CS1)C(=O)CC2C(=O)NCC[NH+]2CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN(CC1=NC=CS1)C(=O)C[C@@H]2C(=O)NCC[NH+]2CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H28N4O2S/c1-28(18-23-26-13-15-32-23)24(30)16-22-25(31)27-12-14-29(22)17-21(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-11,13,15,21-22H,12,14,16-18H2,1H3,(H,27,31)/p+1/t22-/m1/s1