(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 1,3-bis(oxidanylidene)isoindole-2-carbodithioate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 1,3-bis(oxidanylidene)isoindole-2-carbodithioate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 1,3-dioxoisoindoline-2-carbodithioate CAS Name: 1,3-dioxo-2-isoindolecarbodithioic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 1,3-dioxoisoindole-2-carbodithioate Traditional Name: 1,3-diketoisoindoline-2-carbodithioic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C23H14N2O3S3 MolecularWeight: 462.56386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)C(=S)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)C(=S)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C23H14N2O3S3/c26-20(13-30-23(29)25-21(27)14-7-1-2-8-15(14)22(25)28)24-16-9-3-5-11-18(16)31-19-12-6-4-10-17(19)24/h1-12H,13H2