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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C(C)NC2=C(C=C(C=C2)[N+](=O)[O-])Br

Isomeric SMILES

CC1=NC(=CS1)C(C)NC2=C(C=C(C=C2)[N+](=O)[O-])Br

InChI

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