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

Systemtic Name: 2-[[5-[[(4-methylphenyl)amino]methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-1-phenothiazin-10-yl-ethanone Openeye Name: 2-[[5-[(4-methylanilino)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-1-phenothiazin-10-yl-ethanone CAS Name: 2-[[5-[(4-methylanilino)methyl]-1H-1,2,4-triazol-3-yl]thio]-1-(10-phenothiazinyl)ethanone IUPAC Name: 2-[[5-[(4-methylanilino)methyl]-1H-1,2,4-triazol-3-yl]sulfanyl]-1-phenothiazin-10-ylethanone Traditional Name: 1-phenothiazin-10-yl-2-[[5-(p-toluidinomethyl)-1H-1,2,4-triazol-3-yl]thio]ethanone Formula: C24H21N5OS2 MolecularWeight: 459.58644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NCC2=NC(=NN2)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

CC1=CC=C(C=C1)NCC2=NC(=NN2)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C24H21N5OS2/c1-16-10-12-17(13-11-16)25-14-22-26-24(28-27-22)31-15-23(30)29-18-6-2-4-8-20(18)32-21-9-5-3-7-19(21)29/h2-13,25H,14-15H2,1H3,(H,26,27,28)