[(2S)-1-[2-[(4-bromophenyl)amino]-1,3-thiazol-4-yl]propan-2-yl]azanium

Systemtic Name: [(2S)-1-[2-[(4-bromophenyl)amino]-1,3-thiazol-4-yl]propan-2-yl]azanium Openeye Name: [(1S)-2-[2-(4-bromoanilino)thiazol-4-yl]-1-methyl-ethyl]ammonium CAS Name: [(2S)-1-[2-(4-bromoanilino)-4-thiazolyl]propan-2-yl]ammonium IUPAC Name: [(2S)-1-[2-(4-bromoanilino)-1,3-thiazol-4-yl]propan-2-yl]azanium Traditional Name: [(1S)-2-[2-(4-bromoanilino)thiazol-4-yl]-1-methyl-ethyl]ammonium Formula: C12H15BrN3S+ MolecularWeight: 313.2366

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CSC(=N1)NC2=CC=C(C=C2)Br)[NH3+]

Isomeric SMILES

C[C@@H](CC1=CSC(=N1)NC2=CC=C(C=C2)Br)[NH3+]

InChI

InChI=1S/C12H14BrN3S/c1-8(14)6-11-7-17-12(16-11)15-10-4-2-9(13)3-5-10/h2-5,7-8H,6,14H2,1H3,(H,15,16)/p+1/t8-/m0/s1