2-[[1-(4-bromophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1-phenothiazin-10-yl-ethanone

Systemtic Name: 2-[[1-(4-bromophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1-phenothiazin-10-yl-ethanone Openeye Name: 2-[1-(4-bromophenyl)tetrazol-5-yl]sulfanyl-1-phenothiazin-10-yl-ethanone CAS Name: 2-[[1-(4-bromophenyl)-5-tetrazolyl]thio]-1-(10-phenothiazinyl)ethanone IUPAC Name: 2-[1-(4-bromophenyl)tetrazol-5-yl]sulfanyl-1-phenothiazin-10-ylethanone Traditional Name: 2-[[1-(4-bromophenyl)tetrazol-5-yl]thio]-1-phenothiazin-10-yl-ethanone Formula: C21H14BrN5OS2 MolecularWeight: 496.40276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)CSC4=NN=NN4C5=CC=C(C=C5)Br

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)CSC4=NN=NN4C5=CC=C(C=C5)Br

InChI

InChI=1S/C21H14BrN5OS2/c22-14-9-11-15(12-10-14)27-21(23-24-25-27)29-13-20(28)26-16-5-1-3-7-18(16)30-19-8-4-2-6-17(19)26/h1-12H,13H2