[(1S)-2-[[4-chloranyl-3-(thiophen-2-ylcarbonylamino)phenyl]carbonylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[[4-chloranyl-3-(thiophen-2-ylcarbonylamino)phenyl]carbonylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[[4-chloro-3-(thiophene-2-carbonylamino)benzoyl]amino]-1-(3-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[[4-chloro-3-[[oxo(thiophen-2-yl)methyl]amino]phenyl]-oxomethyl]amino]-1-(3-thiophenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[[4-chloro-3-(thiophene-2-carbonylamino)benzoyl]amino]-1-thiophen-3-ylethyl]-dimethylazanium Traditional Name: [(1S)-2-[[4-chloro-3-(2-thenoylamino)benzoyl]amino]-1-(3-thienyl)ethyl]-dimethyl-ammonium Formula: C20H21ClN3O2S2+ MolecularWeight: 434.98264

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2=CC=CS2)C3=CSC=C3

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2=CC=CS2)C3=CSC=C3

InChI

InChI=1S/C20H20ClN3O2S2/c1-24(2)17(14-7-9-27-12-14)11-22-19(25)13-5-6-15(21)16(10-13)23-20(26)18-4-3-8-28-18/h3-10,12,17H,11H2,1-2H3,(H,22,25)(H,23,26)/p+1/t17-/m1/s1