[2-oxidanylidene-2-[[(2S)-3-oxidanylidene-1-phenyl-butan-2-yl]amino]ethyl]-bis(thiophen-2-ylmethyl)azanium

Systemtic Name: [2-oxidanylidene-2-[[(2S)-3-oxidanylidene-1-phenyl-butan-2-yl]amino]ethyl]-bis(thiophen-2-ylmethyl)azanium Openeye Name: [2-[[(1S)-1-benzyl-2-oxo-propyl]amino]-2-oxo-ethyl]-bis(2-thienylmethyl)ammonium CAS Name: [2-oxo-2-[[(2S)-3-oxo-1-phenylbutan-2-yl]amino]ethyl]-bis(thiophen-2-ylmethyl)ammonium IUPAC Name: [2-oxo-2-[[(2S)-3-oxo-1-phenylbutan-2-yl]amino]ethyl]-bis(thiophen-2-ylmethyl)azanium Traditional Name: [2-[[(1S)-1-benzyl-2-keto-propyl]amino]-2-keto-ethyl]-bis(2-thenyl)ammonium Formula: C22H25N2O2S2+ MolecularWeight: 413.5761

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC=CC=C1)NC(=O)C[NH+](CC2=CC=CS2)CC3=CC=CS3

Isomeric SMILES

CC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C[NH+](CC2=CC=CS2)CC3=CC=CS3

InChI

InChI=1S/C22H24N2O2S2/c1-17(25)21(13-18-7-3-2-4-8-18)23-22(26)16-24(14-19-9-5-11-27-19)15-20-10-6-12-28-20/h2-12,21H,13-16H2,1H3,(H,23,26)/p+1/t21-/m0/s1