1-(2-chloranylphenothiazin-10-yl)-2-(3-ethyl-5,7-dimethyl-quinolin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(2-chloranylphenothiazin-10-yl)-2-(3-ethyl-5,7-dimethyl-quinolin-2-yl)sulfanyl-ethanone Openeye Name: 1-(2-chlorophenothiazin-10-yl)-2-[(3-ethyl-5,7-dimethyl-2-quinolyl)sulfanyl]ethanone CAS Name: 1-(2-chloro-10-phenothiazinyl)-2-[(3-ethyl-5,7-dimethyl-2-quinolinyl)thio]ethanone IUPAC Name: 1-(2-chlorophenothiazin-10-yl)-2-(3-ethyl-5,7-dimethylquinolin-2-yl)sulfanylethanone Traditional Name: 1-(2-chlorophenothiazin-10-yl)-2-[(3-ethyl-5,7-dimethyl-2-quinolyl)thio]ethanone Formula: C27H23ClN2OS2 MolecularWeight: 491.06732

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C=C(C=C(C2=C1)C)C)SCC(=O)N3C4=CC=CC=C4SC5=C3C=C(C=C5)Cl

Isomeric SMILES

CCC1=C(N=C2C=C(C=C(C2=C1)C)C)SCC(=O)N3C4=CC=CC=C4SC5=C3C=C(C=C5)Cl

InChI

InChI=1S/C27H23ClN2OS2/c1-4-18-13-20-17(3)11-16(2)12-21(20)29-27(18)32-15-26(31)30-22-7-5-6-8-24(22)33-25-10-9-19(28)14-23(25)30/h5-14H,4,15H2,1-3H3