[2-(3-bromophenyl)-1,3-thiazol-4-yl]methyl-[2-(methylamino)-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-(3-bromophenyl)-1,3-thiazol-4-yl]methyl-[2-(methylamino)-2-oxidanylidene-ethyl]azanium Openeye Name: [2-(3-bromophenyl)thiazol-4-yl]methyl-[2-(methylamino)-2-oxo-ethyl]ammonium CAS Name: [2-(3-bromophenyl)-4-thiazolyl]methyl-[2-(methylamino)-2-oxoethyl]ammonium IUPAC Name: [2-(3-bromophenyl)-1,3-thiazol-4-yl]methyl-[2-(methylamino)-2-oxoethyl]azanium Traditional Name: [2-(3-bromophenyl)thiazol-4-yl]methyl-[2-keto-2-(methylamino)ethyl]ammonium Formula: C13H15BrN3OS+ MolecularWeight: 341.2467

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C[NH2+]CC1=CSC(=N1)C2=CC(=CC=C2)Br

Isomeric SMILES

CNC(=O)C[NH2+]CC1=CSC(=N1)C2=CC(=CC=C2)Br

InChI

InChI=1S/C13H14BrN3OS/c1-15-12(18)7-16-6-11-8-19-13(17-11)9-3-2-4-10(14)5-9/h2-5,8,16H,6-7H2,1H3,(H,15,18)/p+1