[(1R)-1-(3-benzamidophenyl)ethyl]-methyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium

Systemtic Name: [(1R)-1-(3-benzamidophenyl)ethyl]-methyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium Openeye Name: [(1R)-1-(3-benzamidophenyl)ethyl]-methyl-[2-oxo-2-(2-thienylmethylamino)ethyl]ammonium CAS Name: [(1R)-1-(3-benzamidophenyl)ethyl]-methyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]ammonium IUPAC Name: [(1R)-1-(3-benzamidophenyl)ethyl]-methyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]azanium Traditional Name: [(1R)-1-(3-benzamidophenyl)ethyl]-[2-keto-2-(2-thenylamino)ethyl]-methyl-ammonium Formula: C23H26N3O2S+ MolecularWeight: 408.53644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)[NH+](C)CC(=O)NCC3=CC=CS3

Isomeric SMILES

C[C@H](C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)[NH+](C)CC(=O)NCC3=CC=CS3

InChI

InChI=1S/C23H25N3O2S/c1-17(26(2)16-22(27)24-15-21-12-7-13-29-21)19-10-6-11-20(14-19)25-23(28)18-8-4-3-5-9-18/h3-14,17H,15-16H2,1-2H3,(H,24,27)(H,25,28)/p+1/t17-/m1/s1