3-[[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]sulfanyl]-1-phenothiazin-10-yl-propan-1-one

Systemtic Name: 3-[[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]sulfanyl]-1-phenothiazin-10-yl-propan-1-one Openeye Name: 3-[[4,5-bis(p-tolyl)-1H-imidazol-2-yl]sulfanyl]-1-phenothiazin-10-yl-propan-1-one CAS Name: 3-[[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]thio]-1-(10-phenothiazinyl)-1-propanone IUPAC Name: 3-[[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]sulfanyl]-1-phenothiazin-10-ylpropan-1-one Traditional Name: 3-[[4,5-bis(p-tolyl)-1H-imidazol-2-yl]thio]-1-phenothiazin-10-yl-propan-1-one Formula: C32H27N3OS2 MolecularWeight: 533.70628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=C(N2)SCCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)C6=CC=C(C=C6)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=C(N2)SCCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)C6=CC=C(C=C6)C

InChI

InChI=1S/C32H27N3OS2/c1-21-11-15-23(16-12-21)30-31(24-17-13-22(2)14-18-24)34-32(33-30)37-20-19-29(36)35-25-7-3-5-9-27(25)38-28-10-6-4-8-26(28)35/h3-18H,19-20H2,1-2H3,(H,33,34)