(5-bromanylthiophen-2-yl)methyl-methyl-[2-[[4-(methylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-methyl-[2-[[4-(methylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (5-bromo-2-thienyl)methyl-methyl-[2-[4-(methylcarbamoyl)anilino]-2-oxo-ethyl]ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-methyl-[2-[4-(methylcarbamoyl)anilino]-2-oxoethyl]ammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-methyl-[2-[4-(methylcarbamoyl)anilino]-2-oxoethyl]azanium Traditional Name: (5-bromo-2-thienyl)methyl-[2-keto-2-[4-(methylcarbamoyl)anilino]ethyl]-methyl-ammonium Formula: C16H19BrN3O2S+ MolecularWeight: 397.30996

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NC(=O)C[NH+](C)CC2=CC=C(S2)Br

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)NC(=O)C[NH+](C)CC2=CC=C(S2)Br

InChI

InChI=1S/C16H18BrN3O2S/c1-18-16(22)11-3-5-12(6-4-11)19-15(21)10-20(2)9-13-7-8-14(17)23-13/h3-8H,9-10H2,1-2H3,(H,18,22)(H,19,21)/p+1