(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 4-(phenylmethyl)piperazine-1-carbodithioate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 4-(phenylmethyl)piperazine-1-carbodithioate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 4-benzylpiperazine-1-carbodithioate CAS Name: 4-(phenylmethyl)-1-piperazinecarbodithioic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 4-benzylpiperazine-1-carbodithioate Traditional Name: 4-benzylpiperazine-1-carbodithioic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C26H25N3OS3 MolecularWeight: 491.6912

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=S)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=S)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C26H25N3OS3/c30-25(29-21-10-4-6-12-23(21)33-24-13-7-5-11-22(24)29)19-32-26(31)28-16-14-27(15-17-28)18-20-8-2-1-3-9-20/h1-13H,14-19H2