(5-bromanylthiophen-2-yl)methyl-ethyl-[2-oxidanylidene-2-[(4-pyrrolidin-1-ylphenyl)amino]ethyl]azanium

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-ethyl-[2-oxidanylidene-2-[(4-pyrrolidin-1-ylphenyl)amino]ethyl]azanium Openeye Name: (5-bromo-2-thienyl)methyl-ethyl-[2-oxo-2-(4-pyrrolidin-1-ylanilino)ethyl]ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-ethyl-[2-oxo-2-[4-(1-pyrrolidinyl)anilino]ethyl]ammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-ethyl-[2-oxo-2-(4-pyrrolidin-1-ylanilino)ethyl]azanium Traditional Name: (5-bromo-2-thienyl)methyl-ethyl-[2-keto-2-(4-pyrrolidinoanilino)ethyl]ammonium Formula: C19H25BrN3OS+ MolecularWeight: 423.3903

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=C(S1)Br)CC(=O)NC2=CC=C(C=C2)N3CCCC3

Isomeric SMILES

CC[NH+](CC1=CC=C(S1)Br)CC(=O)NC2=CC=C(C=C2)N3CCCC3

InChI

InChI=1S/C19H24BrN3OS/c1-2-22(13-17-9-10-18(20)25-17)14-19(24)21-15-5-7-16(8-6-15)23-11-3-4-12-23/h5-10H,2-4,11-14H2,1H3,(H,21,24)/p+1