2-[5,5-bis(oxidanylidene)phenothiazin-10-yl]-1-[4-(phenylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[5,5-bis(oxidanylidene)phenothiazin-10-yl]-1-[4-(phenylmethyl)piperazin-1-yl]ethanone Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-(5,5-dioxophenothiazin-10-yl)ethanone CAS Name: 2-(5,5-dioxo-10-phenothiazinyl)-1-[4-(phenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-(5,5-dioxophenothiazin-10-yl)ethanone Traditional Name: 1-(4-benzylpiperazino)-2-(5,5-diketophenothiazin-10-yl)ethanone Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CN3C4=CC=CC=C4S(=O)(=O)C5=CC=CC=C53

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CN3C4=CC=CC=C4S(=O)(=O)C5=CC=CC=C53

InChI

InChI=1S/C25H25N3O3S/c29-25(27-16-14-26(15-17-27)18-20-8-2-1-3-9-20)19-28-21-10-4-6-12-23(21)32(30,31)24-13-7-5-11-22(24)28/h1-13H,14-19H2