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

Systemtic Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-1-phenothiazin-10-yl-ethanone Openeye Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-1-phenothiazin-10-yl-ethanone CAS Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-1-(10-phenothiazinyl)ethanone IUPAC Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-1-phenothiazin-10-ylethanone Traditional Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-1-phenothiazin-10-yl-ethanone Formula: C28H20N4OS2 MolecularWeight: 492.6146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64

InChI

InChI=1S/C28H20N4OS2/c33-26(32-22-15-7-9-17-24(22)35-25-18-10-8-16-23(25)32)19-34-28-30-29-27(20-11-3-1-4-12-20)31(28)21-13-5-2-6-14-21/h1-18H,19H2