[(4S)-4-[[(2R,4S)-3-ethanoyl-2-phenyl-1,3-thiazolidin-4-yl]carbonylamino]pentyl]-diethyl-azanium

Systemtic Name: [(4S)-4-[[(2R,4S)-3-ethanoyl-2-phenyl-1,3-thiazolidin-4-yl]carbonylamino]pentyl]-diethyl-azanium Openeye Name: [(4S)-4-[[(2R,4S)-3-acetyl-2-phenyl-thiazolidine-4-carbonyl]amino]pentyl]-diethyl-ammonium CAS Name: [(4S)-4-[[[(2R,4S)-3-acetyl-2-phenyl-4-thiazolidinyl]-oxomethyl]amino]pentyl]-diethylammonium IUPAC Name: [(4S)-4-[[(2R,4S)-3-acetyl-2-phenyl-1,3-thiazolidine-4-carbonyl]amino]pentyl]-diethylazanium Traditional Name: [(4S)-4-[[(2R,4S)-3-acetyl-2-phenyl-thiazolidine-4-carbonyl]amino]pentyl]-diethyl-ammonium Formula: C21H34N3O2S+ MolecularWeight: 392.57856

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)NC(=O)C1CSC(N1C(=O)C)C2=CC=CC=C2

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)NC(=O)[C@H]1CS[C@@H](N1C(=O)C)C2=CC=CC=C2

InChI

InChI=1S/C21H33N3O2S/c1-5-23(6-2)14-10-11-16(3)22-20(26)19-15-27-21(24(19)17(4)25)18-12-8-7-9-13-18/h7-9,12-13,16,19,21H,5-6,10-11,14-15H2,1-4H3,(H,22,26)/p+1/t16-,19+,21+/m0/s1