(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) azepane-1-carbodithioate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) azepane-1-carbodithioate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) azepane-1-carbodithioate CAS Name: 1-azepanecarbodithioic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) azepane-1-carbodithioate Traditional Name: azepane-1-carbodithioic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C21H22N2OS3 MolecularWeight: 414.60718

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)SCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42

Isomeric SMILES

C1CCCN(CC1)C(=S)SCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42

InChI

InChI=1S/C21H22N2OS3/c24-20(15-26-21(25)22-13-7-1-2-8-14-22)23-16-9-3-5-11-18(16)27-19-12-6-4-10-17(19)23/h3-6,9-12H,1-2,7-8,13-15H2