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

Systemtic Name: 6-methyl-2-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-quinoline-3-carbonitrile Openeye Name: 6-methyl-2-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanyl-quinoline-3-carbonitrile CAS Name: 6-methyl-2-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]-3-quinolinecarbonitrile IUPAC Name: 6-methyl-2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanylquinoline-3-carbonitrile Traditional Name: 2-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]-6-methyl-quinoline-3-carbonitrile Formula: C25H17N3OS2 MolecularWeight: 439.55198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C25H17N3OS2/c1-16-10-11-19-17(12-16)13-18(14-26)25(27-19)30-15-24(29)28-20-6-2-4-8-22(20)31-23-9-5-3-7-21(23)28/h2-13H,15H2,1H3