(5-bromanylthiophen-2-yl)methyl-[(2S)-1-[(4-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-azanium

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-[(2S)-1-[(4-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-azanium Openeye Name: (5-bromo-2-thienyl)methyl-[(1S)-2-(4-methoxyanilino)-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-[(2S)-1-(4-methoxyanilino)-1-oxopropan-2-yl]-methylammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-[(2S)-1-(4-methoxyanilino)-1-oxopropan-2-yl]-methylazanium Traditional Name: (5-bromo-2-thienyl)methyl-[(1S)-2-keto-1-methyl-2-(p-anisidino)ethyl]-methyl-ammonium Formula: C16H20BrN2O2S+ MolecularWeight: 384.3112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OC)[NH+](C)CC2=CC=C(S2)Br

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)OC)[NH+](C)CC2=CC=C(S2)Br

InChI

InChI=1S/C16H19BrN2O2S/c1-11(19(2)10-14-8-9-15(17)22-14)16(20)18-12-4-6-13(21-3)7-5-12/h4-9,11H,10H2,1-3H3,(H,18,20)/p+1/t11-/m0/s1