[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(1S)-1-thiophen-2-ylethyl]azanium

Systemtic Name: [2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(1S)-1-thiophen-2-ylethyl]azanium Openeye Name: [2-(3-bromoanilino)-2-oxo-ethyl]-methyl-[(1S)-1-(2-thienyl)ethyl]ammonium CAS Name: [2-(3-bromoanilino)-2-oxoethyl]-methyl-[(1S)-1-thiophen-2-ylethyl]ammonium IUPAC Name: [2-(3-bromoanilino)-2-oxoethyl]-methyl-[(1S)-1-thiophen-2-ylethyl]azanium Traditional Name: [2-(3-bromoanilino)-2-keto-ethyl]-methyl-[(1S)-1-(2-thienyl)ethyl]ammonium Formula: C15H18BrN2OS+ MolecularWeight: 354.28522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)[NH+](C)CC(=O)NC2=CC(=CC=C2)Br

Isomeric SMILES

C[C@@H](C1=CC=CS1)[NH+](C)CC(=O)NC2=CC(=CC=C2)Br

InChI

InChI=1S/C15H17BrN2OS/c1-11(14-7-4-8-20-14)18(2)10-15(19)17-13-6-3-5-12(16)9-13/h3-9,11H,10H2,1-2H3,(H,17,19)/p+1/t11-/m0/s1