2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]-1-phenothiazin-10-yl-butan-1-one

Systemtic Name: 2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]-1-phenothiazin-10-yl-butan-1-one Openeye Name: 2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]-1-phenothiazin-10-yl-butan-1-one CAS Name: 2-[(4,5-diphenyl-1H-imidazol-2-yl)thio]-1-(10-phenothiazinyl)-1-butanone IUPAC Name: 2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]-1-phenothiazin-10-ylbutan-1-one Traditional Name: 2-[(4,5-diphenyl-1H-imidazol-2-yl)thio]-1-phenothiazin-10-yl-butan-1-one Formula: C31H25N3OS2 MolecularWeight: 519.6797

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)SC4=NC(=C(N4)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CCC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)SC4=NC(=C(N4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H25N3OS2/c1-2-25(30(35)34-23-17-9-11-19-26(23)36-27-20-12-10-18-24(27)34)37-31-32-28(21-13-5-3-6-14-21)29(33-31)22-15-7-4-8-16-22/h3-20,25H,2H2,1H3,(H,32,33)