2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-[2-(trifluoromethyl)phenothiazin-10-yl]ethanone

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-[2-(trifluoromethyl)phenothiazin-10-yl]ethanone Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-[2-(trifluoromethyl)phenothiazin-10-yl]ethanone CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-[2-(trifluoromethyl)-10-phenothiazinyl]ethanone IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-[2-(trifluoromethyl)phenothiazin-10-yl]ethanone Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-1-[2-(trifluoromethyl)phenothiazin-10-yl]ethanone Formula: C21H16F3N3OS2 MolecularWeight: 447.49645

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)C

InChI

InChI=1S/C21H16F3N3OS2/c1-12-9-13(2)26-20(25-12)29-11-19(28)27-15-5-3-4-6-17(15)30-18-8-7-14(10-16(18)27)21(22,23)24/h3-10H,11H2,1-2H3