2-(5-bromanyl-1,3-benzothiazol-2-yl)-4-nitro-aniline

Systemtic Name: 2-(5-bromanyl-1,3-benzothiazol-2-yl)-4-nitro-aniline Openeye Name: 2-(5-bromo-1,3-benzothiazol-2-yl)-4-nitro-aniline CAS Name: 2-(5-bromo-1,3-benzothiazol-2-yl)-4-nitroaniline IUPAC Name: 2-(5-bromo-1,3-benzothiazol-2-yl)-4-nitroaniline Traditional Name: [2-(5-bromo-1,3-benzothiazol-2-yl)-4-nitro-phenyl]amine Formula: C13H8BrN3O2S MolecularWeight: 350.19052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C2=NC3=C(S2)C=CC(=C3)Br)N

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C2=NC3=C(S2)C=CC(=C3)Br)N

InChI

InChI=1S/C13H8BrN3O2S/c14-7-1-4-12-11(5-7)16-13(20-12)9-6-8(17(18)19)2-3-10(9)15/h1-6H,15H2