[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-methyl-[2-oxidanylidene-2-(thiophen-2-ylmethylcarbamoylamino)ethyl]azanium

Systemtic Name: [2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-methyl-[2-oxidanylidene-2-(thiophen-2-ylmethylcarbamoylamino)ethyl]azanium Openeye Name: [2-(2-bromoanilino)-2-oxo-ethyl]-methyl-[2-oxo-2-(2-thienylmethylcarbamoylamino)ethyl]ammonium CAS Name: [2-(2-bromoanilino)-2-oxoethyl]-methyl-[2-oxo-2-[[oxo-(thiophen-2-ylmethylamino)methyl]amino]ethyl]ammonium IUPAC Name: [2-(2-bromoanilino)-2-oxoethyl]-methyl-[2-oxo-2-(thiophen-2-ylmethylcarbamoylamino)ethyl]azanium Traditional Name: [2-(2-bromoanilino)-2-keto-ethyl]-[2-keto-2-(2-thenylcarbamoylamino)ethyl]-methyl-ammonium Formula: C17H20BrN4O3S+ MolecularWeight: 440.3347

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC(=O)NC1=CC=CC=C1Br)CC(=O)NC(=O)NCC2=CC=CS2

Isomeric SMILES

C[NH+](CC(=O)NC1=CC=CC=C1Br)CC(=O)NC(=O)NCC2=CC=CS2

InChI

InChI=1S/C17H19BrN4O3S/c1-22(10-15(23)20-14-7-3-2-6-13(14)18)11-16(24)21-17(25)19-9-12-5-4-8-26-12/h2-8H,9-11H2,1H3,(H,20,23)(H2,19,21,24,25)/p+1