2-[(4-bromophenyl)methylsulfonyl]-6-nitro-1,3-benzothiazole

Systemtic Name: 2-[(4-bromophenyl)methylsulfonyl]-6-nitro-1,3-benzothiazole Openeye Name: 2-[(4-bromophenyl)methylsulfonyl]-6-nitro-1,3-benzothiazole CAS Name: 2-[(4-bromophenyl)methylsulfonyl]-6-nitro-1,3-benzothiazole IUPAC Name: 2-[(4-bromophenyl)methylsulfonyl]-6-nitro-1,3-benzothiazole Traditional Name: 2-(4-bromobenzyl)sulfonyl-6-nitro-1,3-benzothiazole Formula: C14H9BrN2O4S2 MolecularWeight: 413.26626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CS(=O)(=O)C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1CS(=O)(=O)C2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C14H9BrN2O4S2/c15-10-3-1-9(2-4-10)8-23(20,21)14-16-12-6-5-11(17(18)19)7-13(12)22-14/h1-7H,8H2