2-[[5-(2-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-1-phenothiazin-10-yl-ethanone

Systemtic Name: 2-[[5-(2-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-1-phenothiazin-10-yl-ethanone Openeye Name: 2-[[5-(2-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-1-phenothiazin-10-yl-ethanone CAS Name: 2-[[5-(2-chlorophenyl)-1H-1,2,4-triazol-3-yl]thio]-1-(10-phenothiazinyl)ethanone IUPAC Name: 2-[[5-(2-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-1-phenothiazin-10-ylethanone Traditional Name: 2-[[5-(2-chlorophenyl)-1H-1,2,4-triazol-3-yl]thio]-1-phenothiazin-10-yl-ethanone Formula: C22H15ClN4OS2 MolecularWeight: 450.9637

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC(=NN2)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC(=NN2)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)Cl

InChI

InChI=1S/C22H15ClN4OS2/c23-15-8-2-1-7-14(15)21-24-22(26-25-21)29-13-20(28)27-16-9-3-5-11-18(16)30-19-12-6-4-10-17(19)27/h1-12H,13H2,(H,24,25,26)