N-[2-(4-bromophenyl)sulfanylethyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine

Systemtic Name: N-[2-(4-bromophenyl)sulfanylethyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine Openeye Name: N-[2-(4-bromophenyl)sulfanylethyl]-1,1-dioxo-1,2-benzothiazol-3-amine CAS Name: N-[2-[(4-bromophenyl)thio]ethyl]-1,1-dioxo-1,2-benzothiazol-3-amine IUPAC Name: N-[2-(4-bromophenyl)sulfanylethyl]-1,1-dioxo-1,2-benzothiazol-3-amine Traditional Name: 2-[(4-bromophenyl)thio]ethyl-(1,1-diketo-1,2-benzothiazol-3-yl)amine Formula: C15H13BrN2O2S2 MolecularWeight: 397.30992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCSC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCSC3=CC=C(C=C3)Br

InChI

InChI=1S/C15H13BrN2O2S2/c16-11-5-7-12(8-6-11)21-10-9-17-15-13-3-1-2-4-14(13)22(19,20)18-15/h1-8H,9-10H2,(H,17,18)