4-bromanyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]-2-nitro-aniline

Systemtic Name: 4-bromanyl-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]-2-nitro-aniline Openeye Name: 4-bromo-N-[1-(4-methylthiazol-5-yl)ethyl]-2-nitro-aniline CAS Name: 4-bromo-N-[1-(4-methyl-5-thiazolyl)ethyl]-2-nitroaniline IUPAC Name: 4-bromo-N-[1-(4-methyl-1,3-thiazol-5-yl)ethyl]-2-nitroaniline Traditional Name: (4-bromo-2-nitro-phenyl)-[1-(4-methylthiazol-5-yl)ethyl]amine Formula: C12H12BrN3O2S MolecularWeight: 342.21158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=N1)C(C)NC2=C(C=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC=N1)C(C)NC2=C(C=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C12H12BrN3O2S/c1-7-12(19-6-14-7)8(2)15-10-4-3-9(13)5-11(10)16(17)18/h3-6,8,15H,1-2H3