[(4S)-4-[(4-bromanylthiophen-2-yl)methylazaniumyl]pentyl]-diethyl-azanium

Systemtic Name: [(4S)-4-[(4-bromanylthiophen-2-yl)methylazaniumyl]pentyl]-diethyl-azanium Openeye Name: [(4S)-4-[(4-bromo-2-thienyl)methylammonio]pentyl]-diethyl-ammonium CAS Name: [(4S)-4-[(4-bromo-2-thiophenyl)methylammonio]pentyl]-diethylammonium IUPAC Name: [(4S)-4-[(4-bromothiophen-2-yl)methylazaniumyl]pentyl]-diethylazanium Traditional Name: [(4S)-4-[(4-bromo-2-thienyl)methylammonio]pentyl]-diethyl-ammonium Formula: C14H27BrN2S+2 MolecularWeight: 335.34658

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)[NH2+]CC1=CC(=CS1)Br

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)[NH2+]CC1=CC(=CS1)Br

InChI

InChI=1S/C14H25BrN2S/c1-4-17(5-2)8-6-7-12(3)16-10-14-9-13(15)11-18-14/h9,11-12,16H,4-8,10H2,1-3H3/p+2/t12-/m0/s1