6-ethoxy-2-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-quinoline-3-carbonitrile

Systemtic Name: 6-ethoxy-2-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-quinoline-3-carbonitrile Openeye Name: 6-ethoxy-2-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanyl-quinoline-3-carbonitrile CAS Name: 6-ethoxy-2-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]-3-quinolinecarbonitrile IUPAC Name: 6-ethoxy-2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanylquinoline-3-carbonitrile Traditional Name: 6-ethoxy-2-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]quinoline-3-carbonitrile Formula: C26H19N3O2S2 MolecularWeight: 469.57796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C26H19N3O2S2/c1-2-31-19-11-12-20-17(14-19)13-18(15-27)26(28-20)32-16-25(30)29-21-7-3-5-9-23(21)33-24-10-6-4-8-22(24)29/h3-14H,2,16H2,1H3