[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methyl-methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium

Systemtic Name: [2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methyl-methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium Openeye Name: [2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methyl-[2-(isopropylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-(5-bromo-2-methoxyphenyl)-4-thiazolyl]methyl-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]ammonium IUPAC Name: [2-(5-bromo-2-methoxyphenyl)-1,3-thiazol-4-yl]methyl-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]azanium Traditional Name: [2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methyl-[2-(isopropylamino)-2-keto-ethyl]-methyl-ammonium Formula: C17H23BrN3O2S+ MolecularWeight: 413.35242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C[NH+](C)CC1=CSC(=N1)C2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CC(C)NC(=O)C[NH+](C)CC1=CSC(=N1)C2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C17H22BrN3O2S/c1-11(2)19-16(22)9-21(3)8-13-10-24-17(20-13)14-7-12(18)5-6-15(14)23-4/h5-7,10-11H,8-9H2,1-4H3,(H,19,22)/p+1