dimethyl-[(2S)-2-phenyl-2-[2-[2-(thiophen-2-ylcarbonylamino)ethanoylamino]ethanoylamino]ethyl]azanium

Systemtic Name: dimethyl-[(2S)-2-phenyl-2-[2-[2-(thiophen-2-ylcarbonylamino)ethanoylamino]ethanoylamino]ethyl]azanium Openeye Name: dimethyl-[(2S)-2-phenyl-2-[[2-[[2-(thiophene-2-carbonylamino)acetyl]amino]acetyl]amino]ethyl]ammonium CAS Name: dimethyl-[(2S)-2-[[1-oxo-2-[[1-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]ethyl]amino]ethyl]amino]-2-phenylethyl]ammonium IUPAC Name: dimethyl-[(2S)-2-phenyl-2-[[2-[[2-(thiophene-2-carbonylamino)acetyl]amino]acetyl]amino]ethyl]azanium Traditional Name: dimethyl-[(2S)-2-phenyl-2-[[2-[[2-(2-thenoylamino)acetyl]amino]acetyl]amino]ethyl]ammonium Formula: C19H25N4O3S+ MolecularWeight: 389.4918

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC(C1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)C2=CC=CS2

Isomeric SMILES

C[NH+](C)C[C@H](C1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)C2=CC=CS2

InChI

InChI=1S/C19H24N4O3S/c1-23(2)13-15(14-7-4-3-5-8-14)22-18(25)12-20-17(24)11-21-19(26)16-9-6-10-27-16/h3-10,15H,11-13H2,1-2H3,(H,20,24)(H,21,26)(H,22,25)/p+1/t15-/m1/s1